SCHEMBL29623749

SCHEMBL29623749

Nc1ccc(-n2cnc3cc(OCCN4CCOCC4)ccc32)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 10/20 0.80
▸ SRC P12931 5/20 0.80
▸ KDR P35968 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.51
▸ MAPT P10636 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ CCNE1 P24864 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ HSF1 Q00613 1/20 0.48
▸ NTRK1 P04629 1/20 0.48
▸ FLT3 P36888 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MCHR1 Q99705 1/20 0.48
▸ NPC1 O15118 1/20 0.46

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
SCHEMBL19350877 1.00 FGFR1 (0.80) FGFR1SRCKDRALDH1A1MAPT
SCHEMBL19350931 0.95 FGFR1 (0.80) FGFR1SRCKDRALDH1A1MAPT
SCHEMBL19350894 0.91 FGFR1 (0.67) FGFR1SRCKDRALDH1A1CYP1A2
SCHEMBL7990149 0.89 FGFR1 (1.00) FGFR1SRCKDRRAB9AMCHR1
SCHEMBL20604018 0.89 FGFR1 (0.63) FGFR1SRCKDRALDH1A1MAPT
Hydrochloric Acid SCHEMBL7987479 0.88 FGFR1 (0.98) FGFR1SRCKDRRAB9ANPC1
SCHEMBL20603905 0.87 FGFR1 (0.73) FGFR1SRCKDRALDH1A1SMN1; SMN2
SCHEMBL20627495 0.84 FGFR1 (0.71) FGFR1SRCKDRALDH1A1CYP1A2
SCHEMBL7986193 0.83 FGFR1 (1.00) FGFR1SRCKDR
SCHEMBL20604001 0.83 FGFR1 (0.73) FGFR1SRCKDRSMN1; SMN2NTRK1

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
EP-3424924-B1 UREA COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF ANCUREALL PHARMACEUTICAL SHANGHAI CO LTD (CN) 2023-05-24 — — EP 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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