SCHEMBL30807008

SCHEMBL30807008

CN(C)CCOc1ccccc1C(=O)Nc1cccc2ccncc12

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 5/20 0.54
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ BRPF1 P55201 1/20 0.48
▸ HTR1B P28222 2/20 0.48
▸ RAB9A P51151 1/20 0.47
▸ TP53 P04637 1/20 0.46
▸ ROCK1 Q13464 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ ATR Q13535 1/20 0.43
▸ MAPT P10636 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ SGMS2 Q8NHU3 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ KDM4E B2RXH2 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
SCHEMBL30806978 0.84 BRPF1 (0.49) RXFP1MEN1KMT2ABRPF1RAB9A
SCHEMBL27195708 0.82 CACNA1H (0.51) KMT2ARAB9AROCK1SMN1; SMN2POLB
SCHEMBL27195785 0.80 LMNA (0.46) —
SCHEMBL9132797 0.77 RXFP1 (0.58) RXFP1MEN1KMT2ABRPF1MAPT
SCHEMBL30806906 0.75 TRPV1 (0.51) RXFP1ROCK1SMN1; SMN2MAPTKDM4E
SCHEMBL27195733 0.74 TRPV1 (0.59) MEN1KMT2ARAB9AROCK1SMN1; SMN2
SCHEMBL11734686 0.74 SMN1; SMN2 (0.52) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL10066976 0.74 RXFP1 (0.64) RXFP1MEN1KMT2ABRPF1RAB9A
SCHEMBL30806836 0.73 PABPC1 (0.54) RXFP1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL26266333 0.73 NPC1 (0.52) MEN1KMT2ARAB9ATP53SMN1; SMN2

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-4353712-A1 NEW N-HETEROARYLBENZAMIDES DERIVATIVES AS FLT3 INHIBITORS Biodol Therapeutics (FR) 2024-04-17 — — EP disclosed
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