SCHEMBL8062006

SCHEMBL8062006

CCCCCCCc1nnc(S)n1N

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
ATM Q13315 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 2/20 0.36
SPNS2 Q8IVW8 2/20 0.35
HTR2A P28223 1/20 0.32
KCNH2 Q12809 1/20 0.32
TLR7 Q9NYK1 2/20 0.32
CETP P11597 1/20 0.32
DNM1 Q05193 1/20 0.31
NPC1 O15118 1/20 0.31
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL11808356 1.00 ALDH1A1 (0.49) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL9677868 1.00 ALDH1A1 (0.49) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL6741751 1.00 ALDH1A1 (0.49) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL11805405 1.00 ALDH1A1 (0.49) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL9222262 1.00 ALDH1A1 (0.49) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL10012951 0.92 ALDH1A1 (0.56) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL9522466 0.86 ALDH1A1 (0.56) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL2160524 0.86 ALDH1A1 (0.56) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL5924299 0.86 ALDH1A1 (0.56) ALDH1A1LMNATSHRATMSMN1; SMN2
SCHEMBL8352379 0.85 CA2 (0.40) ALDH1A1LMNATSHRATMSMN1; SMN2

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
EP-0811880-B1 A kit of parts for making analkaline processing liquid for processing a lithographic printing plate AGFA GEVAERT NV (BE) 2000-05-31 EP disclosed
US-5763149-A Kit of parts for making an alkaline processing liquid for processing a lithographic printing plate AGFA-GEVAERT, N.V. (BE) 1998-06-09 US disclosed
EP-0811880-A1 A kit of parts for making analkaline processing liquid for processing a lithographic printing plate AGFA-GEVAERT N.V. (BE) 1997-12-10 EP disclosed
US-3954981-A Triazolocycloalkylhydrothiadiazine derivatives RICHARDSON-MERRELL INC. (US) 1976-05-04 US disclosed
US-3954984-A ANTISECRETRETORY AGENTS, CENTRAL NERVOUS SYSTEM DEPRESSANTS RICHARDSON-MERRELL INC. (US) 1976-05-04 US disclosed