SCHEMBL29623418

SCHEMBL29623418

CC(C)(C)c1cc(NC(=O)Nc2ccc(-n3cnc4cc(OCCN5CCCCC5)ccc43)cc2)no1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 12/20 0.63
▸ NTRK1 P04629 2/20 0.61
▸ KDR P35968 5/20 0.58
▸ ALK Q9UM73 2/20 0.58
▸ AURKA O14965 2/20 0.58
▸ RET P07949 10/20 0.55
▸ CSF1R P07333 4/20 0.55
▸ PDGFRB P09619 4/20 0.55
▸ KIT P10721 4/20 0.55
▸ DDR1 Q08345 3/20 0.55
▸ PDGFRA P16234 3/20 0.55
▸ LCK P06239 2/20 0.55
▸ FLT4 P35916 2/20 0.55
▸ CDK8 P49336 2/20 0.55
▸ DDR2 Q16832 2/20 0.55
▸ MKNK2 Q9HBH9 2/20 0.55
▸ BMPR1B O00238 1/20 0.55
▸ MUSK O15146 1/20 0.55
▸ EPHB6 O15197 1/20 0.55
▸ MAP3K7 O43318 1/20 0.55

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
SCHEMBL29623675 1.00 FLT3 (0.63) FLT3NTRK1KDRALKAURKA
SCHEMBL19350961 1.00 FLT3 (0.63) FLT3NTRK1KDRALKAURKA
SCHEMBL19350840 1.00 FLT3 (0.63) FLT3NTRK1KDRALKAURKA
SCHEMBL29623245 0.93 RET (0.64) FLT3NTRK1KDRAURKARET
SCHEMBL19350793 0.93 RET (0.64) FLT3NTRK1KDRAURKARET
SCHEMBL29623585 0.90 FLT3 (0.64) FLT3NTRK1KDRALKAURKA
SCHEMBL19350843 0.90 FLT3 (0.64) FLT3NTRK1KDRALKAURKA
SCHEMBL20627772 0.88 FLT3 (0.55) FLT3NTRK1KDRALKAURKA
SCHEMBL20627506 0.88 FLT3 (0.55) FLT3NTRK1KDRALKAURKA
SCHEMBL29623342 0.88 RET (0.53) FLT3NTRK1KDRRETCSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109071523-B Urea compound, preparation method and medical application thereof 恩瑞生物医药科技(上海)有限公司 2022-05-31 — — CN claimed
EP-3424924-B1 UREA COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF ANCUREALL PHARMACEUTICAL SHANGHAI CO LTD (CN) 2023-05-24 — — EP disclosed
CN-109071523-B Urea compound, preparation method and medical application thereof 恩瑞生物医药科技(上海)有限公司 2022-05-31 — — CN disclosed
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