SCHEMBL28805494

SCHEMBL28805494

Cc1ccccc1-c1[nH]nnc1CO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.45
▸ RAB9A P51151 5/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.38
▸ NPC1 O15118 4/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ PIK3CD O00329 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ PRKDC P78527 1/20 0.36
▸ HPGD P15428 5/20 0.36
▸ ALOX15 P16050 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ USP2 O75604 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 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
SCHEMBL29818805 0.81 KDM4E (0.41) GAARAB9ASMN1; SMN2NPC1CASP3
SCHEMBL28327759 0.75 GAA (0.46) GAARAB9ASMN1; SMN2NPC1CASP3
SCHEMBL27599916 0.74 GAA (0.44) GAARAB9ASMN1; SMN2NPC1CASP3
SCHEMBL2918163 0.74 PIK3CD (0.49) GAARAB9ASMN1; SMN2NPC1CASP3
SCHEMBL28327760 0.73 FYN (0.40) GAAPPARGL3MBTL1
SCHEMBL1290355 0.72 HPGD (0.41) GAARAB9ASMN1; SMN2NPC1CASP3
SCHEMBL28264086 0.71 ALDH1A1 (0.45) GAARAB9ASMN1; SMN2NPC1CASP3
Phosphine SCHEMBL8166357 0.71 HPGD (0.40) GAARAB9ASMN1; SMN2NPC1CASP3
SCHEMBL9173123 0.71 GAA (0.39) GAARAB9ASMN1; SMN2NPC1CASP3
SCHEMBL30839322 0.70 GAA (0.41) GAARAB9ASMN1; SMN2NPC1CASP3

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
CN-104081501-B Chemically mechanical polishing (CMP) composition comprising protein 巴斯夫欧洲公司 2019-02-01 — — CN disclosed
CN-105934487-B Include chemically mechanical polishing (CMP) composition of polyaminoacid 巴斯夫欧洲公司 2018-10-26 — — CN disclosed
CN-103261097-A Lignosulfonate grafts with an acid, ester and non-onic monomers AKZO NOBEL CHEMICALS INT BV 2013-08-21 — — CN disclosed
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