SCHEMBL460023

SCHEMBL460023

O=C(O)c1ccc(-c2cnc(NC(=O)N3CCC(=Cc4ccccn4)CC3)s2)nc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 3/20 0.46
CSNK2A1 P68400 3/20 0.46
CNR2 P34972 1/20 0.41
OGA O60502 3/20 0.40
NPY5R Q15761 2/20 0.39
LDHA P00338 1/20 0.37
SRD5A2 P31213 3/20 0.36
KDR P35968 1/20 0.36
SCD O00767 1/20 0.36
NAMPT P43490 2/20 0.35
MKNK1 Q9BUB5 1/20 0.35
GSTO1 P78417 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL457632 0.91 OGA (0.42) CSNK2A2CSNK2A1CNR2OGANPY5R
SCHEMBL458505 0.89 CNR2 (0.49) CSNK2A2CSNK2A1CNR2OGANPY5R
SCHEMBL458766 0.88 CNR2 (0.40) CNR2OGANPY5RMKNK1GSTO1
SCHEMBL458611 0.83 OGA (0.42) CNR2OGANPY5RNAMPTNPC1
SCHEMBL459750 0.81 OGA (0.41) OGASRD5A2NAMPTRAB9A
SCHEMBL460463 0.81 OGA (0.45) CSNK2A2CSNK2A1CNR2OGANPY5R
SCHEMBL457743 0.81 PTPN1 (0.44) NPY5RLDHANAMPT
SCHEMBL460222 0.81 CNR2 (0.47) CNR2OGANPY5RKDRSCD
SCHEMBL460254 0.80 CNR2 (0.44) CSNK2A2CSNK2A1CNR2OGANPY5R
SCHEMBL460070 0.79 KDR (0.46) CNR2NPY5RKDRSCDNPC1

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 CSNK2A2 3578/4885CSNK2A1 3557/4885CNR2 180/4885

“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.