SCHEMBL25614255

SCHEMBL25614255

CC(F)(F)c1cc(CNC(=O)N[C@H]2C[C@@H]3CC[C@H]2C3)ccn1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 5/20 0.43
▸ NAMPT P43490 1/20 0.42
▸ HPGD P15428 2/20 0.41
▸ BRS3 P32247 7/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ EPHX1 P07099 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
SCHEMBL30399087 1.00 EPHX2 (0.43) EPHX2NAMPTHPGDBRS3ALDH1A1
SCHEMBL25614257 0.93 EPHX2 (0.48) EPHX2NAMPTHPGDALDH1A1EPHX1
SCHEMBL30398665 0.93 EPHX2 (0.48) EPHX2NAMPTHPGDALDH1A1EPHX1
SCHEMBL25639850 0.88 EPHX2 (0.43) EPHX2NAMPTHPGDALDH1A1EPHX1
SCHEMBL30398893 0.81 EPHX2 (0.48) EPHX2NAMPTHPGDALDH1A1EPHX1
SCHEMBL25615176 0.81 EPHX2 (0.48) EPHX2NAMPTHPGDALDH1A1EPHX1
SCHEMBL25615170 0.81 EPHX2 (0.48) EPHX2NAMPTHPGDALDH1A1EPHX1
SCHEMBL30399998 0.81 EPHX2 (0.45) EPHX2NAMPTHPGDALDH1A1EPHX1
SCHEMBL30399847 0.81 EPHX2 (0.45) EPHX2NAMPTHPGDALDH1A1
SCHEMBL25638890 0.81 EPHX2 (0.45) EPHX2NAMPTHPGDALDH1A1

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-2023091554-A1 NOVEL HETEROARYL-UREA COMPOUNDS AS KV7.2 INHIBITORS ICAGEN, LLC (US) 2023-05-25 — — WO disclosed
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