SCHEMBL4143337

SCHEMBL4143337

Cc1c(C(=O)NC2CC2)cccc1-c1ccc(Br)nc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.45
▸ ALOX5AP P20292 3/20 0.45
▸ KMT2A Q03164 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ P2RX7 Q99572 1/20 0.44
▸ MAP4K4 O95819 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ GRIN2B Q13224 1/20 0.42
▸ TGFBR1 P36897 1/20 0.42
▸ FEN1 P39748 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40

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
SCHEMBL15559049 0.81 CRHR1 (0.49) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL4005323 0.75 MAPK14 (0.66) KDR
SCHEMBL18190616 0.74 SMYD3 (0.50) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL18887343 0.74 ABL1 (0.68) GAAALOX5APFEN1ABL1KDR
SCHEMBL1987660 0.73 TAS1R3 (0.64) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL28536621 0.72 PPARG (0.42) GAAALOX5APKMT2AALDH1A1MEN1
SCHEMBL960202 0.72 RAB9A (0.50) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL1233190 0.72 MEN1 (0.47) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL3172457 0.71 TAS1R3 (0.59) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL738587 0.71 P2RX7 (0.71) GAAKMT2AALDH1A1MEN1SMN1; 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-2009078992-A1 LINEAR TRICYCLIC COMPOUNDS AS P38 KINASE INHIBITORS AMGEN INC. (US) 2009-06-25 — — WO disclosed
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