SCHEMBL10695926

SCHEMBL10695926

Cc1csc(CCCC(=O)Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.39
LTB4R Q15722 4/20 0.37
ALDH1A1 P00352 2/20 0.36
TP53 P04637 2/20 0.36
KDM4C Q9H3R0 1/20 0.35
TSHR P16473 2/20 0.34
MAOA P21397 1/20 0.32
GSK3B P49841 1/20 0.31
METAP2 P50579 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HCAR3 P49019 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
PDE10A Q9Y233 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
SCHEMBL8540112 0.89 DAO (0.41) DAOLTB4RALDH1A1TP53KDM4C
SCHEMBL2037474 0.84 LTB4R (0.48) DAOLTB4RALDH1A1KDM4CTSHR
SCHEMBL8588999 0.83 DAO (0.32) DAOLTB4RKDM4C
SCHEMBL2033883 0.79 CYP1A2 (0.43) DAOALDH1A1TSHRSMN1; SMN2
SCHEMBL2407624 0.78 DAO (0.44) DAOALDH1A1KDM4CMAOAGSK3B
SCHEMBL2399697 0.77 DAO (0.47) DAOLTB4RALDH1A1KDM4CSMN1; SMN2
SCHEMBL8855371 0.77 DAO (0.42) DAOLTB4RALDH1A1TP53KDM4C
SCHEMBL81915 0.76 DAO (0.36) DAOKDM4C
SCHEMBL7354171 0.74 IAPP (0.41) DAOLTB4RALDH1A1TP53KDM4C
SCHEMBL28318893 0.74 ALDH1A1 (0.38) DAOALDH1A1TP53NPC1RAB9A

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
EP-0267439-A2 Alpha-(phenylalkyl) pyridinealkanol derivatives G.D. Searle & Co. (US) 1988-05-18 EP disclosed