SCHEMBL7110909

SCHEMBL7110909

C=CCONCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HRAS P01112 1/20 0.41
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH7 P40394 1/20 0.41
IDO1 P14902 2/20 0.40
THRB P10828 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP3A4 P08684 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
CASP1 P29466 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL23610152 0.78 ALDH1A1 (0.55) SMN1; SMN2L3MBTL1IDO1MEN1KMT2A
SCHEMBL29196358 0.77 IDO1 (0.41) IDO1MEN1KMT2AALDH1A1
SCHEMBL206646 0.74 HRAS (0.65) HRASADH1BADH1CADH1AADH7
SCHEMBL10667657 0.72 IDO1 (0.44) HRASADH1BADH1CADH1AADH7
SCHEMBL2178103 0.72 CYP3A4 (0.48) SMN1; SMN2HRASIDO1THRBMEN1
SCHEMBL15103137 0.72 IDO1 (0.50) HRASADH1BADH1CADH1AADH7
Hydrochloric Acid SCHEMBL6967279 0.72 HRAS (0.62) HRASIDO1THRBMEN1KMT2A
SCHEMBL10776729 0.72 HRAS (0.68) HRASIDO1THRBMEN1KMT2A
SCHEMBL336981 0.71 CA2 (0.47) HRASIDO1THRBMEN1KMT2A
Hydrochloric Acid SCHEMBL27547964 0.71 MAPT (0.52) SMN1; SMN2L3MBTL1HRASIDO1THRB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117795036-A Perovskite quantum dot composite material, printing ink and manufacturing method of perovskite quantum dot composite material 伊势化学工业株式会社 2024-03-29 CN disclosed
EP-1300402-A1 Alkoxybenzylamines with antimicrobial properties Ciba SC Holding AG (CH) 2003-04-09 EP disclosed
EP-0819000-A4 NODULISPORIC ACID DERIVATIVES MERCK & CO INC (US) 2001-04-11 EP disclosed
EP-0819000-A1 NODULISPORIC ACID DERIVATIVES Merck & Co., Inc. (US) 1998-01-21 EP disclosed
US-4398944-A N-ALKOXYPHENYLMETHYL-2-CHLOROACETAMIDE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1983-08-16 US disclosed