SCHEMBL20627772

SCHEMBL20627772

CC(C)(C)c1cc(NCNc2ccc(-n3cnc4cc(OCCN5CCCCCC5)ccc43)cc2)no1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 8/20 0.55
▸ NTRK1 P04629 4/20 0.55
▸ KDR P35968 8/20 0.50
▸ FGFR1 P11362 3/20 0.49
▸ SRC P12931 3/20 0.49
▸ ALK Q9UM73 2/20 0.44
▸ AURKA O14965 1/20 0.44
▸ RET P07949 5/20 0.44
▸ CSF1R P07333 3/20 0.42
▸ PDGFRB P09619 2/20 0.42
▸ KIT P10721 2/20 0.42
▸ DDR1 Q08345 2/20 0.42
▸ BMPR1B O00238 1/20 0.42
▸ MUSK O15146 1/20 0.42
▸ EPHB6 O15197 1/20 0.42
▸ MAP3K7 O43318 1/20 0.42
▸ RIPK2 O43353 1/20 0.42
▸ PAK3 O75914 1/20 0.42
▸ STK10 O94804 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42

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
SCHEMBL20627506 1.00 FLT3 (0.55) FLT3NTRK1KDRFGFR1SRC
SCHEMBL29623418 0.88 FLT3 (0.63) FLT3NTRK1KDRALKAURKA
SCHEMBL19350840 0.88 FLT3 (0.63) FLT3NTRK1KDRALKAURKA
SCHEMBL19350961 0.88 FLT3 (0.63) FLT3NTRK1KDRALKAURKA
SCHEMBL29623675 0.88 FLT3 (0.63) FLT3NTRK1KDRALKAURKA
SCHEMBL20627743 0.85 FGFR1 (0.52) FLT3NTRK1KDRFGFR1SRC
SCHEMBL19350793 0.81 RET (0.64) FLT3NTRK1KDRFGFR1SRC
SCHEMBL29623245 0.81 RET (0.64) FLT3NTRK1KDRFGFR1SRC
SCHEMBL20627759 0.80 NTRK1 (0.66) FLT3NTRK1KDRFGFR1SRC
SCHEMBL29623585 0.78 FLT3 (0.64) FLT3NTRK1KDRALKAURKA

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
EP-3424924-A1 UREA COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF Ancureall Pharmaceutical (Shanghai) Co., Ltd. (CN) 2019-01-09 — — EP disclosed
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