SCHEMBL10948147

SCHEMBL10948147

NC(=O)c1c(OCc2ccccc2)ccc2c1CCC/C2=N/O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRB P28702 8/20 0.40
RXRA P19793 7/20 0.40
RXRG P48443 6/20 0.40
MRGPRX4 Q96LA9 2/20 0.39
PARP10 Q53GL7 1/20 0.39
PTGER1 P34995 3/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
BRD4 O60885 1/20 0.38
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
CYP2C9 P11712 1/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL10948152 1.00 RXRB (0.40) RXRBRXRARXRGMRGPRX4PARP10
SCHEMBL10880896 0.87 RXRA (0.41) RXRBRXRARXRGMRGPRX4PPARG
SCHEMBL10880892 0.87 RXRA (0.41) RXRBRXRARXRGMRGPRX4PPARG
SCHEMBL10951400 0.85 MRGPRX4 (0.55) RXRBRXRARXRGMRGPRX4PTGER1
SCHEMBL11726269 0.81 RAB9A (0.47) RXRBRXRARXRGMRGPRX4PTGER1
SCHEMBL11720690 0.81 RAB9A (0.47) RXRBRXRARXRGMRGPRX4PTGER1
SCHEMBL10955123 0.80 ALDH1A1 (0.51) RXRBRXRARXRGPTGER1ALDH1A1
SCHEMBL10955119 0.80 ALDH1A1 (0.51) RXRBRXRARXRGPTGER1ALDH1A1
SCHEMBL11725755 0.78 RAB9A (0.44) RXRBRXRARXRGMRGPRX4BRD4
SCHEMBL11721103 0.78 NPC1 (0.39) RXRBRXRARXRGMRGPRX4BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4559361-A INTRAOCULAR PRESSURE DEPRESSANTS, TREATMENT OF GLAUCOMA SENJU PHARMACEUTICAL CO., LTD. (JP) 1985-12-17 US disclosed