SCHEMBL926810

SCHEMBL926810

O=Cc1cnc2c(F)c(NC(=O)c3ccc(OCC4CC4)cc3)ccc2c1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 0.55
HTR2C P28335 1/20 0.47
NR1H4 Q96RI1 1/20 0.45
GPR35 Q9HC97 1/20 0.43

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
SCHEMBL927883 0.89 MCHR1 (0.69) MCHR1HTR2C
SCHEMBL929243 0.86 MCHR1 (0.62) MCHR1HTR2CNR1H4
SCHEMBL929262 0.86 MCHR1 (0.62) MCHR1HTR2CNR1H4
SCHEMBL13673962 0.82 MCHR1 (0.61) MCHR1HTR2C
SCHEMBL928427 0.81 MCHR1 (0.55) MCHR1HTR2CGPR35
SCHEMBL567061 0.80 MCHR1 (0.59) MCHR1
SCHEMBL928389 0.80 MCHR1 (0.61) MCHR1HTR2C
SCHEMBL926849 0.79 MCHR1 (0.70) MCHR1HTR2C
SCHEMBL928429 0.79 MCHR1 (0.53) MCHR1
SCHEMBL926995 0.79 MCHR1 (0.53) MCHR1HTR2CGPR35

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-20110015225-A1 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-20 US disclosed
US-20110015225-A1 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-20 US disclosed
US-20110015225-A1 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-20 US disclosed
EP-2261213-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-12-15 EP disclosed
EP-2261213-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-12-15 EP disclosed
WO-2009123194-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-10-08 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-20110015225-A1 Heterocyclic compound MC1R, MCHR1, MCHR2 MCHR1 2/4885HTR2C 81/4885NR1H4 302/4885

“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.