SCHEMBL14793323

SCHEMBL14793323

O=Nc1cc(F)cc(CSC2CC2)c1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.35
▸ KMT2A Q03164 1/20 0.33
▸ PARP14 Q460N5 1/20 0.32
▸ QRFPR Q96P65 1/20 0.32

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
SCHEMBL15723894 0.76 LMNA (0.33) —
SCHEMBL14793320 0.75 QRFPR (0.48) KMT2APARP14QRFPR
SCHEMBL14785262 0.75 EPHX1 (0.37) EPHX1KMT2APARP14
SCHEMBL28370073 0.72 KMT2A (0.41) KMT2AQRFPR
SCHEMBL14785329 0.72 CXCR4 (0.34) EPHX1KMT2A
SCHEMBL18202491 0.70 QRFPR (0.55) EPHX1KMT2AQRFPR
SCHEMBL23027747 0.67 CES2 (0.33) —
SCHEMBL11957883 0.67 CES2 (0.39) —
SCHEMBL8375338 0.63 — —
SCHEMBL28861481 0.59 ACHE (0.36) —

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
WO-2013037894-A1 DISUBSTITUTED 5-FLUORO PYRIMIDINE DERIVATIVES CONTAINING A SULFOXIMINE GROUP BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-03-21 — — WO disclosed
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