SCHEMBL7967421

SCHEMBL7967421

C=C/C=C(\C=C(\C)N)c1ccc(NC(=O)Nc2ccccc2SC)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 12/20 0.54
▸ MEN1 O00255 11/20 0.54
▸ MAPT P10636 12/20 0.53
▸ RAB9A P51151 10/20 0.53
▸ NPC1 O15118 6/20 0.53
▸ SMN1; SMN2 Q16637 6/20 0.53
▸ LMNA P02545 1/20 0.53
▸ PKM P14618 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.48
▸ KDM4E B2RXH2 1/20 0.45
▸ POLB P06746 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.39

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
SCHEMBL7971048 0.89 RAB9A (0.42) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7968918 0.87 RAB9A (0.54) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7967861 0.86 RAB9A (0.51) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7975277 0.86 RAB9A (0.55) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7966143 0.85 HTT (0.53) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7970330 0.84 RAB9A (0.64) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7955588 0.84 CA12 (0.53) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7977635 0.84 CA12 (0.51) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7974448 0.83 BDKRB1 (0.44) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL7974449 0.83 KDM4E (0.54) KMT2AMAPTRAB9ANPC1SMN1; SMN2

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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