SCHEMBL18770683

SCHEMBL18770683

Cc1c(C(=O)O)cccc1-c1cc(=O)[nH]nc1-c1cc(Br)cnc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 1/20 0.40
▸ LDHB P07195 1/20 0.40
▸ PTGER1 P34995 1/20 0.38
▸ MYC P01106 1/20 0.33
▸ POLB P06746 3/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ HPGD P15428 3/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ MEN1 O00255 3/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ CHRM2 P08172 1/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ RRM1 P23921 1/20 0.32
▸ RRM2B Q7LG56 1/20 0.32
▸ MAP4K4 O95819 2/20 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
SCHEMBL18770608 0.79 MAP4K4 (0.47) LDHALDHBMAP4K4DYRK1BPTGS1
SCHEMBL18770665 0.73 GPR119 (0.46) GPR119
SCHEMBL18770690 0.73 CDK8 (0.42) MAP4K4
SCHEMBL19327549 0.69 FGFR1 (0.38) LDHALDHBPOLBALDH1A1SMN1; SMN2
SCHEMBL5046158 0.66 MYC (0.59) PTGER1MYCPOLBALDH1A1HPGD
SCHEMBL30731125 0.64 KMT2A (0.48) ALDH1A1SMN1; SMN2MEN1KMT2AHTT
SCHEMBL30731191 0.64 ATR (0.40) ALDH1A1SMN1; SMN2MEN1KMT2AHTT
SCHEMBL3813226 0.64 ALDH1A1 (0.46) PTGER1MYCPOLBALDH1A1HPGD
SCHEMBL836163 0.64 KMT2A (0.52) POLBALDH1A1SMN1; SMN2L3MBTL1MEN1
SCHEMBL30861515 0.64 KMT2A (0.52) POLBALDH1A1SMN1; SMN2L3MBTL1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3365335-A1 2-ARYL- AND 2-HETEROARYL-SUBSTITUTED 2-PYRIDAZIN-3(2H)-ONE COMPOUNDS AS INHIBITORS OF FGFR TYROSINE KINASES Array Biopharma, Inc. (US) 2018-08-29 — — EP disclosed
WO-2017070708-A1 2-ARYL- AND 2-HETEROARYL-SUBSTITUTED 2-PYRIDAZIN-3(2H)-ONE COMPOUNDS AS INHIBITORS OF FGFR TYROSINE KINASES ARRAY BIOPHARMA, INC. (US) 2017-04-27 — — WO disclosed
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