SCHEMBL15097627

SCHEMBL15097627

COSc1c(C(C)C)c(C#N)c(C(C)C)c(C#N)c1C(C)C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
AKR1B1 P15121 1/20 0.31

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
SCHEMBL15097623 0.79 AKR1B1 (0.33) AKR1B1
SCHEMBL18348918 0.72 TSHR (0.33) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL15097632 0.68
SCHEMBL15097618 0.68
SCHEMBL15097608 0.65 AR (0.39) KDM4EALDH1A1AKR1B1
SCHEMBL15097497 0.65
SCHEMBL15097514 0.64 AKR1B1 (0.33) AKR1B1
SCHEMBL15097706 0.64
SCHEMBL21410740 0.63 TRPV4 (0.30)
SCHEMBL21410256 0.63 KDM4E (0.30) KDM4EMEN1ALDH1A1HPGDKMT2A

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-20130177851-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-11 US disclosed