SCHEMBL10074955

SCHEMBL10074955

NC(=O)C(=O)N1CCOc2ccc(OC(F)(F)F)cc2C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 6/20 0.47
PIK3CA P42336 9/20 0.43
GPR142 Q7Z601 2/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
P2RY1 P47900 1/20 0.38
EPHX2 P34913 1/20 0.38

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
SCHEMBL10070995 0.91 RIPK1 (0.48) RIPK1PIK3CAGPR142ESR1ESR2
SCHEMBL14023336 0.88 RIPK1 (0.48) RIPK1PIK3CAGPR142ESR1ESR2
SCHEMBL807151 0.86 RIPK1 (0.47) RIPK1PIK3CAGPR142ESR1ESR2
SCHEMBL10070490 0.85 RIPK1 (0.44) RIPK1PIK3CAGPR142
SCHEMBL10075222 0.82 RIPK1 (0.46) RIPK1PIK3CAESR2
SCHEMBL10070492 0.81 RYR2 (0.46) RIPK1PIK3CAGPR142
SCHEMBL10074953 0.78 RIPK1 (0.46) RIPK1PIK3CAESR2
SCHEMBL806685 0.77 CYP3A4 (0.43) RIPK1PIK3CAP2RY1EPHX2
SCHEMBL14480703 0.75 PIK3CA (0.51) RIPK1PIK3CAGPR142EPHX2
SCHEMBL807044 0.74 RYR2 (0.58) RIPK1GPR142ESR1ESR2

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
WO-2012019071-A1 METHODS OF PREVENTING AND TREATING SARCOPENIA THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-02-09 WO disclosed
WO-2008144483-A2 AGENTS FOR TREATING DISORDERS INVOLVING MODULATION OF RYANODINE RECEPTORS ARMGO PHARMA, INC. (US) 2008-11-27 WO disclosed