SCHEMBL10046222

SCHEMBL10046222

CC(C)C(=O)[C@H](N)CNC(=N)N

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
GFPT1 Q06210 1/20 0.32
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
GABRP O00591 2/20 0.30
GABRD O14764 2/20 0.30
GABRA1 P14867 2/20 0.30
GABRB1 P18505 2/20 0.30
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 0.30
GABRA5 P31644 2/20 0.30
GABRA3 P34903 2/20 0.30
GABRA2 P47869 2/20 0.30
GABRB2 P47870 2/20 0.30
GABRA4 P48169 2/20 0.30
GABRE P78334 2/20 0.30
GABRA6 Q16445 2/20 0.30
GABRG1 Q8N1C3 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10046223 1.00 DPP4 (0.32) DPP4DPP8DPP9GFPT1CYP2D6
SCHEMBL10046221 1.00 DPP4 (0.32) DPP4DPP8DPP9GFPT1CYP2D6
SCHEMBL19891849 0.83 DPP4 (0.33) DPP4DPP8DPP9
SCHEMBL18821637 0.83
SCHEMBL10046241 0.82 CYP2D6 (0.32) CYP2D6CYP2C19
SCHEMBL10046240 0.82 CYP2D6 (0.32) CYP2D6CYP2C19
SCHEMBL10046239 0.82 CYP2D6 (0.32) CYP2D6CYP2C19
SCHEMBL25132012 0.81 ANPEP (0.39) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL12132309 0.81 ANPEP (0.39) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL13363467 0.81 ANPEP (0.39) GABRPGABRDGABRA1GABRB1GABRG2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11911412-B2 Derivatized chitosan polymers and methods of treating vascular disorders SYNEDGEN, INC. (US) 2024-02-27 US disclosed
US-11786547-B2 Methods and compositions for disrupting biofilm utilizing chitosan-derivative compounds SYNEDGEN, INC. (US) 2023-10-17 US disclosed
US-11786547-B2 Methods and compositions for disrupting biofilm utilizing chitosan-derivative compounds SYNEDGEN, INC. (US) 2023-10-17 US disclosed
US-11717532-B2 Methods and compositions for treating wounds utilizing chitosan compounds SYNEDGEN, INC. (US) 2023-08-08 US disclosed
US-11717532-B2 Methods and compositions for treating wounds utilizing chitosan compounds SYNEDGEN, INC. (US) 2023-08-08 US disclosed
US-20230201248-A1 COMPOSITIONS AND METHODS OF USE THEREOF SYNEDGEN, INC. 2023-06-29 US disclosed
US-20230201248-A1 COMPOSITIONS AND METHODS OF USE THEREOF SYNEDGEN, INC. 2023-06-29 US disclosed
US-20230181623-A1 COMPOSITIONS AND METHODS OF USE FOR WOUND HEALING SYNEDGEN, INC. 2023-06-15 US disclosed
US-20230021050-A1 COMPOSITIONS AND METHODS OF THEIR USE SYNEDGEN, INC. 2023-01-19 US disclosed
US-20220160754-A1 DERIVATIZED CHITOSAN POLYMERS AND METHODS OF TREATING VASCULAR DISORDERS SYNEDGEN, INC. 2022-05-26 US disclosed
US-20120295355-A1 NUCLEIC ACID DELIVERY USING MODIFIED CHITOSANS BAKER SHENDA (US) 2012-11-22 US disclosed
US-8119780-B2 Chitosan-derivative compounds and methods of controlling microbial populations SYNEDGEN, INC. (US) 2012-02-21 US disclosed
WO-2011028968-A1 ORAL CARE METHODS AND COMPOSITIONS UTILIZING CHITOSAN-DERIVATIVE COMPOUNDS SYNEDGEN, INC. (US) 2011-03-10 WO disclosed
WO-2011028967-A1 METHODS AND COMPOSITIONS FOR DISRUPTING BIOFILM UTILIZING CHITOSAN-DERIVATIVE COMPOUNDS SYNEDGEN INC. (US) 2011-03-10 WO disclosed
US-20100137193-A1 CHITOSAN DERIVATIVES TO TREAT ANIMALS OR OPTIMIZE ANIMAL HEALTH SYNEDGEN INC. (US) 2010-06-03 US disclosed
US-20100130443-A1 CHITOSAN DERIVATIVES, COMPOSITIONS AND RELATED METHODS OF USE SYNEDGEN INC. (US) 2010-05-27 US disclosed
WO-2010056927-A1 CHITOSAN DERIVATIVES ALONE OR IN COMBINATION FOR THE TREATMENT OF MDR MICROBIAL INFECTIONS SYNEDGEN, INC. (US) 2010-05-20 WO disclosed
US-20100056474-A1 Methods and Compositions for the Prevention of and Treatment of Infections Utilizing Chitosan-Derivative Compounds UNITED STATES GOVERNMENT 2010-03-04 US disclosed
WO-2010021930-A1 PREVENTION AND TREATMENT OF MRSA INFECTIONS WITH CHITOSAN-DERIVATIVES SYNEDGEN, INC. (US) 2010-02-25 WO disclosed
US-20070281904-A1 Chitosan-derivative compounds and methods of controlling microbial populations UNITED STATES GOVERNMENT 2007-12-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230181623-A1 COMPOSITIONS AND METHODS OF USE FOR WOUND HEALING PARG, ARGLU1, AREG DPP4 2000/4885DPP8 1362/4885DPP9 971/4885
US-20100137193-A1 CHITOSAN DERIVATIVES TO TREAT ANIMALS OR OPTIMIZE ANIMAL HEALTH CHIT1, CHIA, ALG1 DPP4 499/4885DPP8 724/4885DPP9 401/4885
US-20220160754-A1 DERIVATIZED CHITOSAN POLYMERS AND METHODS OF TREATING VASCULAR DISORDERS CHIA, CHI3L1, CHI3L2 DPP4 1065/4885DPP8 838/4885DPP9 860/4885
US-20100056474-A1 Methods and Compositions for the Prevention of and Treatment of Infections Utilizing Chitosan-Derivative Compounds NRDC, ARG1, CHIA DPP4 1129/4885DPP8 1401/4885DPP9 355/4885
US-20230021050-A1 COMPOSITIONS AND METHODS OF THEIR USE ARG1, ARG2, FUT6 DPP4 1375/4885DPP8 1860/4885DPP9 2354/4885
US-20070281904-A1 Chitosan-derivative compounds and methods of controlling microbial populations ARG1, NRDC, CHIA DPP4 111/4885DPP8 538/4885DPP9 201/4885
US-11717532-B2 Methods and compositions for treating wounds utilizing chitosan compounds CHIA, MMP8, CHIT1 DPP4 778/4885DPP8 873/4885DPP9 764/4885
US-20230201248-A1 COMPOSITIONS AND METHODS OF USE THEREOF ENGASE, FUT5, ALG1 DPP4 913/4885DPP8 1136/4885DPP9 947/4885
US-11786547-B2 Methods and compositions for disrupting biofilm utilizing chitosan-derivative compounds CHIT1, ALG1, CSGALNACT1 DPP4 1777/4885DPP8 1609/4885DPP9 1243/4885
US-20100130443-A1 CHITOSAN DERIVATIVES, COMPOSITIONS AND RELATED METHODS OF USE CHIT1, CHIA, ALG1 DPP4 1189/4885DPP8 1505/4885DPP9 546/4885
US-11911412-B2 Derivatized chitosan polymers and methods of treating vascular disorders CHIA, CHI3L1, CHI3L2 DPP4 1065/4885DPP8 838/4885DPP9 860/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.