SCHEMBL9431925

SCHEMBL9431925

CCCCCN(CCCC=O)CCCCC

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
FAAH O00519 2/20 0.54
TRPV1 Q8NER1 2/20 0.54
ALDH1A1 P00352 2/20 0.43
HIF1A Q16665 1/20 0.41
ADH1C P00326 3/20 0.39
ADH1A P07327 3/20 0.39
ADH4 P08319 2/20 0.39
ADH1B P00325 2/20 0.39
ADH7 P40394 2/20 0.39
EPHX1 P07099 1/20 0.39
DNM1 Q05193 3/20 0.39
KDM5A P29375 3/20 0.37
PHF8 Q9UPP1 2/20 0.37
KDM4C Q9H3R0 1/20 0.37

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
SCHEMBL30481037 0.93 TSHR (0.73) TSHRFAAHTRPV1ALDH1A1HIF1A
SCHEMBL7677802 0.93 TSHR (0.62) TSHRFAAHTRPV1ALDH1A1HIF1A
SCHEMBL25710164 0.91 TSHR (0.70) TSHRFAAHTRPV1ALDH1A1HIF1A
SCHEMBL7674518 0.91 TSHR (0.61) TSHRFAAHTRPV1ALDH1A1HIF1A
SCHEMBL1638658 0.88 TSHR (0.55) TSHRFAAHTRPV1ALDH1A1HIF1A
SCHEMBL1638660 0.86 TSHR (0.54) TSHRFAAHTRPV1ALDH1A1HIF1A
SCHEMBL25058741 0.84 TSHR (0.59) TSHRFAAHTRPV1ALDH1A1ADH1C
SCHEMBL22920282 0.84 TSHR (0.59) TSHRFAAHTRPV1ALDH1A1ADH1C
SCHEMBL25856420 0.84 TSHR (0.59) TSHRFAAHTRPV1ALDH1A1ADH1C
SCHEMBL22642669 0.84 TSHR (0.59) TSHRFAAHTRPV1ALDH1A1ADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5358949-A Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-25 US disclosed
EP-0236140-A2 Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-09-09 EP disclosed