SCHEMBL460191

SCHEMBL460191

Cc1noc(C)c1-c1ccc2nc(NC(=O)N3CCC(=Cc4ccccn4)CC3)sc2c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.44
NPC1 O15118 6/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
BRD4 O60885 1/20 0.43
POLB P06746 2/20 0.43
LIPG Q9Y5X9 1/20 0.42
ABL1 P00519 6/20 0.42
KIT P10721 1/20 0.42
TRPV1 Q8NER1 3/20 0.42
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PCSK9 Q8NBP7 1/20 0.41
OPRK1 P41145 1/20 0.41
HTT P42858 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
SCHEMBL458334 0.84 ITK (0.51) RAB9ANPC1SMN1; SMN2POLBABL1
SCHEMBL459961 0.83 PIK3CG (0.46) RAB9ANPC1SMN1; SMN2POLBABL1
SCHEMBL458913 0.82 PIK3CG (0.56) RAB9ANPC1SMN1; SMN2ABL1KIT
SCHEMBL458364 0.82 TRPV1 (0.44) RAB9ANPC1SMN1; SMN2POLBABL1
SCHEMBL460061 0.81 HPGDS (0.55) RAB9ANPC1SMN1; SMN2POLBTRPV1
SCHEMBL460334 0.81 TRPV1 (0.47) RAB9ANPC1SMN1; SMN2POLBTRPV1
SCHEMBL460519 0.81 PIK3CG (0.58) RAB9ANPC1POLBABL1TRPV1
SCHEMBL458405 0.81 ABL1 (0.47) POLBABL1TRPV1MAPTKDM4E
SCHEMBL15103274 0.80 NPC1 (0.52) RAB9ANPC1SMN1; SMN2LIPG
SCHEMBL458775 0.79 SMN1; SMN2 (0.57) RAB9ANPC1SMN1; SMN2POLBTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181183-B2 Prostaglandin D synthase inhibitory piperidine compounds TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-11-10 US claimed
EP-2615084-B1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS TAIHO PHARMACEUTICAL CO LTD (JP) 2016-01-06 EP disclosed
US-9181183-B2 Prostaglandin D synthase inhibitory piperidine compounds TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-11-10 US disclosed
EP-2615084-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS Taiho Pharmaceutical Co., Ltd. (JP) 2013-07-17 EP disclosed
US-20130165438-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2013-06-27 US disclosed
WO-2012033069-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS 大鵬薬品工業株式会社 (JP) 2012-03-15 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-20130165438-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS PTGIS, PTGS1, PTGDR RAB9A 3049/4885NPC1 2377/4885SMN1; SMN2 4361/4885

“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.