SCHEMBL9510328

SCHEMBL9510328

CCNc1cccc(NC(=O)COC(C)=O)c1C#N

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.53
ALDH1A1 P00352 2/20 0.50
HSD17B10 Q99714 1/20 0.50
GAA P10253 1/20 0.45
HPGD P15428 2/20 0.44
USP2 O75604 1/20 0.44
NLRP3 Q96P20 1/20 0.41
MAPT P10636 2/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
TSHR P16473 2/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL9510386 0.92 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1HSD17B10GAAHPGD
SCHEMBL9510636 0.89 GAA (0.44) SMN1; SMN2ALDH1A1GAANLRP3POLB
SCHEMBL9510256 0.87 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1HSD17B10GAAHPGD
SCHEMBL9511695 0.87 GAA (0.60) SMN1; SMN2ALDH1A1HSD17B10GAAHPGD
SCHEMBL9512455 0.86 KDM4E (0.52) ALDH1A1HSD17B10GAAHPGDNLRP3
SCHEMBL9510325 0.83 SMN1; SMN2 (0.55) SMN1; SMN2ALDH1A1HSD17B10GAAHPGD
SCHEMBL9510278 0.83 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1HSD17B10GAAHPGD
SCHEMBL9510380 0.82 TSHR (0.43) SMN1; SMN2ALDH1A1HSD17B10GAAHPGD
SCHEMBL9510267 0.82 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1HSD17B10GAAHPGD
SCHEMBL9510654 0.81 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1HSD17B10GAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0382216-B1 Novel substituted acetamide compounds TOYO BOSEKI (JP) 1993-10-20 EP claimed
US-5041462-A Novel substituted acetamide compounds and use as anti-allergic agents TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-08-20 US claimed
EP-0382216-A1 Novel substituted acetamide compounds Toyo Boseki Kabushiki Kaisha (JP) 1990-08-16 EP claimed
JP-2209856-A None JP disclosed
EP-0382216-B1 Novel substituted acetamide compounds TOYO BOSEKI (JP) 1993-10-20 EP disclosed
US-5041462-A Novel substituted acetamide compounds and use as anti-allergic agents TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-08-20 US disclosed
JP-H02209856-A NEW SUBSTITUTED ACETAMIDE COMPOUND TOYOBO CO LTD 1990-08-21 JP disclosed
EP-0382216-A1 Novel substituted acetamide compounds Toyo Boseki Kabushiki Kaisha (JP) 1990-08-16 EP disclosed