SCHEMBL7974449

SCHEMBL7974449

C=C/C=C(\C=C(\C)N)c1ccc(NC(=O)Nc2ccccc2C#N)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.54
▸ GAA P10253 5/20 0.54
▸ ALDH1A1 P00352 4/20 0.53
▸ GLA P06280 1/20 0.53
▸ CA12 O43570 2/20 0.52
▸ CA1 P00915 2/20 0.52
▸ CA2 P00918 2/20 0.52
▸ CA9 Q16790 2/20 0.52
▸ ALOX15 P16050 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ CXCR2 P25025 1/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ HPGD P15428 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ LMNA P02545 3/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPC1 O15118 2/20 0.38
▸ MAPT P10636 2/20 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
SCHEMBL7968918 0.85 RAB9A (0.54) GAAALDH1A1ALOX15HSD17B10SMN1; SMN2
SCHEMBL7967861 0.84 RAB9A (0.51) KDM4EGAAALDH1A1CXCR2SMN1; SMN2
SCHEMBL7975277 0.84 RAB9A (0.55) KDM4EGAACA12CA1CA2
SCHEMBL7967421 0.83 KMT2A (0.54) KDM4EALDH1A1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL7966143 0.83 HTT (0.53) KDM4EGAASMN1; SMN2L3MBTL1RAB9A
SCHEMBL7970330 0.82 RAB9A (0.64) ALDH1A1CA12CA1CA2CA9
SCHEMBL7955588 0.82 CA12 (0.53) KDM4ECA12CA1CA2CA9
SCHEMBL7977635 0.82 CA12 (0.51) ALDH1A1CA12CA1CA2CA9
SCHEMBL7967465 0.81 MAPT (0.56) GAAALDH1A1CA12CA1CA2
SCHEMBL7974448 0.81 BDKRB1 (0.44) KDM4EALDH1A1SMN1; SMN2HPGDL3MBTL1

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-2009137404-A1 UREA COMPOUNDS AS GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2009-11-12 — — WO disclosed
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