SCHEMBL6833211

SCHEMBL6833211

N#Cc1ccc(NC(=O)c2cc(CCCc3ccccc3)on2)c(C(=O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.46
MAPK1 P28482 3/20 0.46
HSD17B10 Q99714 1/20 0.46
RAB9A P51151 5/20 0.44
NPC1 O15118 3/20 0.44
SCD O00767 2/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.43
HDAC6 Q9UBN7 2/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
ALB P02768 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
MCL1 Q07820 1/20 0.41
BCL2A1 Q16548 1/20 0.41

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
SCHEMBL6834689 0.86 SMN1; SMN2 (0.43) SMN1; SMN2MAPK1HSD17B10RAB9ANPC1
SCHEMBL6821584 0.85 RAB9A (0.51) SMN1; SMN2MAPK1HSD17B10RAB9ANPC1
SCHEMBL6834263 0.85 SMN1; SMN2 (0.52) SMN1; SMN2MAPK1HSD17B10RAB9ANPC1
SCHEMBL6822132 0.84 ALB (0.45) SMN1; SMN2MAPK1HSD17B10RAB9ANPC1
SCHEMBL6835713 0.84 ALB (0.45) SMN1; SMN2MAPK1HSD17B10RAB9ANPC1
SCHEMBL6833099 0.83 ALB (0.42) SMN1; SMN2MAPK1HSD17B10RAB9ANPC1
SCHEMBL6833758 0.81 SMN1; SMN2 (0.41) SMN1; SMN2MAPK1HSD17B10RAB9ANPC1
SCHEMBL6835621 0.80 SCD (0.42) SCDALDH1A1HPGDALBTDP1
SCHEMBL6813729 0.79 TDP1 (0.55) SMN1; SMN2RAB9ANPC1SCDALDH1A1
SCHEMBL16143633 0.78 ALB (0.40) SMN1; SMN2MAPK1HSD17B10RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 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 (1 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 SMN1; SMN2 2022/4885MAPK1 2575/4885HSD17B10 2592/4885

“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.