SCHEMBL6987611

SCHEMBL6987611

CC(C)n1nc(-c2cc(OCCN3CC3)nn2-c2ccccc2)ccc1=O

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.44

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
SCHEMBL6990721 0.96 SIGMAR1 (0.46) SIGMAR1
SCHEMBL6987526 0.95 SIGMAR1 (0.47) SIGMAR1
SCHEMBL6988597 0.93 SIGMAR1 (0.53) SIGMAR1
SCHEMBL6987419 0.88 ALDH1A1 (0.43)
SCHEMBL6987971 0.86 HTT (0.38)
SCHEMBL6987183 0.85 TSHR (0.45)
SCHEMBL6983312 0.85 HTT (0.37)
SCHEMBL6984423 0.84 ATM (0.38)
SCHEMBL6982995 0.83 HRH3 (0.39)
SCHEMBL6987686 0.83 SIGMAR1 (0.45) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313733-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-28 EP disclosed
WO-2002018382-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-07 WO disclosed