SCHEMBL29494484

SCHEMBL29494484

Cc1ccc(NC(=O)CN)cc1C(=O)NCc1ncn2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ BCHE P06276 1/20 0.39
▸ BTK Q06187 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ NOTUM Q6P988 5/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ KLKB1 P03952 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ ATAD2 Q6PL18 1/20 0.36
▸ LMNA P02545 3/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ BLK P51451 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL29494547 0.73 RAB9A (0.48) SMN1; SMN2HTTBCHEBTKHPGD
SCHEMBL29494503 0.72 HDAC1 (0.44) SMN1; SMN2HTTBCHENOTUMALDH1A1
SCHEMBL29494535 0.71 KLKB1 (0.49) SMN1; SMN2HPGDALDH1A1RAB9ANPC1
SCHEMBL29494461 0.71 BLK (0.50) SMN1; SMN2HTTBCHEBTKHPGD
SCHEMBL29494276 0.68 MEN1 (0.62) HPGDALDH1A1RAB9ANPC1MEN1
SCHEMBL29494480 0.68 MEN1 (0.42) SMN1; SMN2HTTBCHEALDH1A1RAB9A
SCHEMBL29494509 0.67 NOTUM (0.47) NOTUMRAB9ANPC1KLKB1
SCHEMBL29494470 0.66 METTL3 (0.43) SMN1; SMN2HTTBCHEKLKB1MEN1
SCHEMBL24501603 0.64 DRD4 (0.38) RAB9ANPC1KLKB1MEN1KMT2A
SCHEMBL29494447 0.63 MAPT (0.50) SMN1; SMN2HTTBCHEBTKHPGD

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-2022070048-A1 NOVEL AMIDE DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2022-04-07 — — WO disclosed
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