SCHEMBL20627046

SCHEMBL20627046

O=CNc1ccc(-n2cnc3cc(OCCN4CCCCC4)ccc32)cc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 1/20 0.63
▸ FLT3 P36888 1/20 0.63
▸ KDR P35968 5/20 0.60
▸ FGFR1 P11362 8/20 0.57
▸ SRC P12931 5/20 0.57
▸ CCNT1 O60563 1/20 0.46
▸ CCNE1 P24864 1/20 0.46
▸ CDK2 P24941 1/20 0.46
▸ CDK9 P50750 1/20 0.46
▸ HSF1 Q00613 1/20 0.46
▸ KCNH2 Q12809 2/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.45
▸ MCHR1 Q99705 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44

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
SCHEMBL20627495 0.90 FGFR1 (0.71) NTRK1FLT3KDRFGFR1SRC
SCHEMBL20627759 0.87 NTRK1 (0.66) NTRK1FLT3KDRFGFR1SRC
SCHEMBL20627764 0.81 FGFR1 (0.49) FGFR1SRCALDH1A1HPGD
SCHEMBL7353127 0.79 LTA4H (0.58) KCNH2HRH3
SCHEMBL14656703 0.78 FGFR1 (0.64) KDRFGFR1ALDH1A1HPGD
SCHEMBL20627045 0.78 FGFR1 (0.49) FGFR1SRCALDH1A1HPGD
SCHEMBL19350865 0.76 FGFR1 (0.55) FGFR1SRCALDH1A1HPGD
SCHEMBL20627063 0.76 FGFR1 (0.55) FGFR1SRCALDH1A1HPGD
SCHEMBL20604001 0.76 FGFR1 (0.73) NTRK1FLT3KDRFGFR1SRC
SCHEMBL25487479 0.76 SMN1; SMN2 (0.47) FGFR1ALDH1A1HPGD

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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