SCHEMBL20828525

SCHEMBL20828525

O=Cc1ccc(C(=O)Nc2ccc(-c3nnc(COc4cccc(C(F)(F)F)c4)[nH]3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.45
▸ GAA P10253 2/20 0.45
▸ FFAR1 O14842 1/20 0.44
▸ PTPN1 P18031 1/20 0.44
▸ PLG P00747 2/20 0.42
▸ PLAU P00749 2/20 0.42
▸ PLAT P00750 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ TRPV1 Q8NER1 3/20 0.41
▸ BRAF P15056 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ RXFP1 Q9HBX9 2/20 0.41
▸ CHEK2 O96017 1/20 0.40

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
SCHEMBL20828389 0.86 FFAR1 (0.46) RAB9AGAAFFAR1PTPN1PLG
SCHEMBL20828380 0.84 CSF1R (0.47) RAB9AGAAFFAR1PLGPLAU
SCHEMBL20828529 0.83 HIF1A (0.46) RAB9AGAAFFAR1PTPN1MAPT
SCHEMBL20828384 0.80 RXFP1 (0.47) FFAR1POLBRXFP1
SCHEMBL20828477 0.79 RXFP1 (0.45) RAB9AFFAR1PLAUTRPV1MAPT
SCHEMBL20828516 0.76 RAB9A (0.50) RAB9AGAAFFAR1PTPN1L3MBTL1
SCHEMBL22237402 0.75 LMNA (0.52) L3MBTL1POLBCHEK2
SCHEMBL4970019 0.71 TRPV1 (0.67) RAB9ATRPV1MAPT
SCHEMBL31395292 0.69 POLB (0.60) RAB9APTPN1L3MBTL1ALDH1A1POLB
SCHEMBL10316101 0.67 COMT (0.44) RAB9APOLBTRPV1

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
WO-2019054430-A1 AMIDE COMPOUND HAVING AROMATIC HETEROCYCLE 第一三共株式会社 2019-03-21 — — WO disclosed
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