SCHEMBL25544100

SCHEMBL25544100

COc1ccc(-c2ccn(C3(C(=O)C(C)C)CCCCC3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 6/20 0.37
SLC6A3 Q01959 6/20 0.37
SLC6A2 P23975 4/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.36
CNR1 P21554 1/20 0.36
HTR2A P28223 1/20 0.36
HRH1 P35367 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
ACHE P22303 1/20 0.35
CTSK P43235 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MAPT P10636 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL21747240 0.88 MMP1 (0.37) SLC6A4SLC6A3SLC6A2ALDH1A1HPGD
SCHEMBL21765802 0.87 ACHE (0.39) SLC6A3ALDH1A1LMNAACHECTSK
SCHEMBL21747365 0.86 CTSK (0.39) SLC6A3ALDH1A1HPGDTDP1ACHE
SCHEMBL25544091 0.85 HSD11B1 (0.33) SLC6A2ALDH1A1
SCHEMBL25544096 0.85 KDM4E (0.36) SLC6A4SLC6A3SLC6A2
SCHEMBL25544076 0.85 SLC6A2 (0.38) SLC6A4SLC6A3SLC6A2ALDH1A1
SCHEMBL25544113 0.83 SLC6A2 (0.35) SLC6A4SLC6A3SLC6A2ALDH1A1HPGD
SCHEMBL25544129 0.81 PTGS2 (0.34) SLC6A4SLC6A3SLC6A2ALDH1A1HPGD
SCHEMBL25543982 0.76 P2RX3 (0.37) SLC6A4SLC6A3ALDH1A1HPGDTDP1
SCHEMBL21765544 0.75 ACHE (0.39) SLC6A4SLC6A3SLC6A2ACHEMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257379-A1 INDOLIZINE DERIVATIVES AND THEIR APPLICATION IN MEDICINE KIND PHARMACEUTICAL (CN) 2023-08-17 US disclosed
US-20230242527-A1 INDOLIZINE DERIVATIVES AND THEIR APPLICATION IN MEDICINE KIND PHARMACEUTICAL (CN) 2023-08-03 US disclosed
US-11655249-B2 Indolizine derivatives and their application in medicine KIND PHARMACEUTICAL (CN) 2023-05-23 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 (3 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-20230257379-A1 INDOLIZINE DERIVATIVES AND THEIR APPLICATION IN MEDICINE INMT, IDO1, IDO2 SLC6A4 28/4885SLC6A3 132/4885SLC6A2 48/4885
US-20230242527-A1 INDOLIZINE DERIVATIVES AND THEIR APPLICATION IN MEDICINE INMT, IDO1, IDO2 SLC6A4 28/4885SLC6A3 132/4885SLC6A2 48/4885
US-11655249-B2 Indolizine derivatives and their application in medicine INMT, IDO1, IDO2 SLC6A4 28/4885SLC6A3 132/4885SLC6A2 48/4885

“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.