SCHEMBL7127611

SCHEMBL7127611

Cc1ccc(C(=O)Nc2nc3ccc(N)cc3s2)cc1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.71
RAB9A P51151 6/20 0.71
KDM4E B2RXH2 5/20 0.71
SMN1; SMN2 Q16637 5/20 0.71
ALDH1A1 P00352 5/20 0.71
TDP1 Q9NUW8 2/20 0.71
RXFP1 Q9HBX9 2/20 0.71
ATM Q13315 1/20 0.71
SCD O00767 2/20 0.69
MAP3K5 Q99683 1/20 0.68
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
HPGD P15428 3/20 0.61
KLK7 P49862 1/20 0.61
LRRK2 Q5S007 2/20 0.59
GAA P10253 1/20 0.59
DYRK1A Q13627 1/20 0.58
GFER P55789 1/20 0.56

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
SCHEMBL13329390 0.89 MAP3K5 (0.83) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL16562169 0.88 NPC1 (0.73) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL4912185 0.88 SCD (0.73) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL21568214 0.87 NPC1 (0.71) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL2190326 0.87 LRRK2 (0.72) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL22130146 0.86 SCD (0.87) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL31219331 0.86 SCD (0.87) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL14807662 0.86 MAP3K5 (0.70) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL13329360 0.86 HSD17B1 (0.74) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL2190685 0.86 NPC1 (0.70) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1

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
WO-2019217509-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER HB THERAPEUTICS INC. (US) 2019-11-14 WO disclosed
CN-1440383-A PPAR gamma modulators SANKYO CO (JP) 2003-09-03 CN disclosed
US-20030134859-A1 PPAR-gamma modulator SANKYO COMPANY, LIMITED (JP) 2003-07-17 US disclosed
EP-1277729-A1 PPAR (GAMMA) MODULATORS Sankyo Company, Limited (JP) 2003-01-22 EP 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-20030134859-A1 PPAR-gamma modulator PPARG, PPARA, PPARD NPC1 1152/4885RAB9A 1179/4885KDM4E 2489/4885

“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.