SCHEMBL9902353

SCHEMBL9902353

O=C(O)N1CCOc2c(-c3cccc(F)c3)csc2C1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.43
TRPM8 Q7Z2W7 3/20 0.39
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SCD O00767 1/20 0.37
GPR142 Q7Z601 1/20 0.37
PLAUR Q03405 1/20 0.36
SCD5 Q86SK9 2/20 0.36
RAB9A P51151 1/20 0.35
TACR3 P29371 1/20 0.35
PDE4B Q07343 1/20 0.35
MTOR P42345 1/20 0.34
GRIN2B Q13224 1/20 0.34
NR4A1 P22736 1/20 0.34
NR4A2 P43354 1/20 0.34
NR4A3 Q92570 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
SCHEMBL9901781 0.85 MKNK1 (0.42) RIPK1TRPM8SMN1; SMN2SCD5
SCHEMBL9902355 0.80 GRM2 (0.39) RIPK1KDM4ESMN1; SMN2SCDSCD5
SCHEMBL9903679 0.80 GRM2 (0.39) RIPK1KDM4ESMN1; SMN2SCDSCD5
SCHEMBL9903640 0.78 RIPK1 (0.38) RIPK1
SCHEMBL9903564 0.72 HTR7 (0.37) RIPK1KDM4ESMN1; SMN2PDE4B
SCHEMBL9902640 0.69 BRD4 (0.40) SCD5
SCHEMBL9902312 0.67 RIPK1 (0.33) RIPK1
SCHEMBL3283691 0.66 MAPK1 (0.43) RIPK1PDE4B
SCHEMBL12465745 0.64 HSD17B10 (0.51) KDM4ESMN1; SMN2RAB9ANR4A1NR4A2
SCHEMBL27791860 0.62 MAPT (0.43) TRPM8KDM4ESMN1; SMN2RAB9APDE4B

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
US-8916549-B2 Thienooxazepine derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-12-23 US disclosed
EP-2463290-B1 THIENOOXAZEPINE DERIVATIVE TAKEDA PHARMACEUTICAL (JP) 2014-03-05 EP disclosed
US-20120196848-A1 THIENOOXAZEPINE DERIVATIVE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-08-02 US disclosed
EP-2463290-A1 THIENOOXAZEPINE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2012-06-13 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-20120196848-A1 THIENOOXAZEPINE DERIVATIVE HTR2C, HTR2B, HTR2A RIPK1 2833/4885TRPM8 95/4885KDM4E 2389/4885

“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.