SCHEMBL21392895

SCHEMBL21392895

C=CC(=O)NCC(c1c(F)cccc1F)N1CC(C)OC(C)C1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
TGM2 P21980 3/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 2/20 0.36
MC4R P32245 2/20 0.35
P2RX7 Q99572 2/20 0.35
HSD17B10 Q99714 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CXCR2 P25025 1/20 0.34
BTK Q06187 1/20 0.34
UBE2M P61081 1/20 0.33
DCUN1D1 Q96GG9 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL9420472 0.60 ALDH1A1 (0.37) MAPTNPC1POLBHSD17B10SMN1; SMN2
SCHEMBL23536584 0.58 TSHR (0.61) NPC1RAB9AHSD17B10SMN1; SMN2KMT2A
SCHEMBL28717475 0.57 TGM2 (0.48) TGM2NPC1RAB9AP2RX7
SCHEMBL17183746 0.57 NPC1 (0.54) MAPTTGM2NPC1RAB9ASMN1; SMN2
SCHEMBL2930088 0.57 CES2 (0.47) TGM2RAB9A
SCHEMBL28315151 0.57 NPC1 (0.57) MAPTTGM2NPC1RAB9APOLB
SCHEMBL4732340 0.57 ALDH1A1 (0.62) TGM2KMT2A
SCHEMBL3317174 0.56 HRH4 (0.39) NPC1RAB9AKMT2A
SCHEMBL30949051 0.56 TGM2 (0.53) TGM2RAB9APOLBBTK
SCHEMBL2125085 0.56 TSHR (0.50) TGM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11666661-B2 Methods and compounds for targeted autophagy THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-06 US disclosed
US-11666661-B2 Methods and compounds for targeted autophagy THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-06 US disclosed
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-12-02 US disclosed
US-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY FRONTIER MEDICINES CORPORATION 2019-09-26 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-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY ATG7, BECN1, SQSTM1 MAPT 442/4885TGM2 2225/4885NPC1 37/4885
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES RNF114, RNF4, RNF168 MAPT 961/4885TGM2 3684/4885NPC1 2966/4885
US-11666661-B2 Methods and compounds for targeted autophagy ATG7, BECN1, SQSTM1 MAPT 442/4885TGM2 2225/4885NPC1 37/4885

“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.