SCHEMBL7213201

SCHEMBL7213201

CCCCc1noc(-c2ccccc2C(=O)O)n1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
MAPT P10636 1/20 0.49
PKM P14618 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CHRM2 P08172 3/20 0.47
CHRM4 P08173 3/20 0.47
CHRM5 P08912 3/20 0.47
CHRM1 P11229 3/20 0.47
CHRM3 P20309 3/20 0.47
AGTR1 P30556 2/20 0.46
AGTR2 P50052 2/20 0.46
USP2 O75604 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL7394051 0.79 TDP1 (0.54) TDP1NPC1RAB9AKDM4EALDH1A1
SCHEMBL7214906 0.77 ALDH1A1 (0.57) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL1257626 0.75 TSHR (0.60) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL96973 0.74 TDP1 (0.44) TDP1NPC1RAB9AKDM4EALDH1A1
SCHEMBL96972 0.72 ALDH1A1 (0.44) TDP1NPC1RAB9AKDM4EALDH1A1
SCHEMBL25181813 0.72 FOLH1 (0.53) AGTR1AGTR2TSHR
SCHEMBL3045765 0.72 CHUK (0.59) TDP1NPC1RAB9AKDM4EALDH1A1
SCHEMBL28021662 0.71 CHRM2 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10389733 0.71 KDM4E (0.59) KDM4EALDH1A1USP2TSHR
SCHEMBL11620605 0.71 PPARA (0.48) KDM4EALDH1A1SMN1; SMN2HSD17B10AGTR1

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-6624309-B1 Administering 4-heterocyclicbenzamide derivative BRISTOL-MYERS SQUIBB COMPANY 2003-09-23 US disclosed
US-20020137968-A1 Benzoic acid derivatives and related compounds as antiarrhythmic agents LLOYD JOHN (US) 2002-09-26 US disclosed
WO-1998037068-A1 BENZOIC ACID DERIVATIVES AND RELATED COMPOUNDS AS ANTIARRHYTHMIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-08-27 WO 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-20020137968-A1 Benzoic acid derivatives and related compounds as antiarrhythmic agents SCN1A, SCN1B, NR0B1 TDP1 1500/4885NPC1 531/4885RAB9A 3323/4885

“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.