SCHEMBL8556915

SCHEMBL8556915

Cc1cc2c(c3c1NC(=O)C3(C)C)OC(CN(C)c1ccccc1)C2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PDK2 Q15119 1/20 0.30
PDK4 Q16654 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
Hydrochloric Acid SCHEMBL8560029 0.85 METAP1 (0.32)
SCHEMBL8555358 0.79 KMT2A (0.30) PDK2PDK4
SCHEMBL8554977 0.79 PRKAB2 (0.34) PDK2PDK4
Hydrochloric Acid SCHEMBL8553946 0.78 PRKAB2 (0.34)
Hydrochloric Acid SCHEMBL8556674 0.78 DRD2 (0.45)
SCHEMBL8558902 0.77 SIRT2 (0.30)
Hydrochloric Acid SCHEMBL8556096 0.76 AQP1 (0.40)
Hydrochloric Acid SCHEMBL8555800 0.72 HRH3 (0.32) ALDH1A1
SCHEMBL9223830 0.72 ALDH1A1 (0.36) USP2ALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL8556528 0.71 ALDH1A1 (0.36) USP2ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0653426-B1 Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same KOWA CO (JP) 1998-07-22 EP disclosed
US-5510366-A INOTROPIC, ANTIARRHYMTHMIA AGENTS, VASODILATORS KOWA CO., LTD. (JP) 1996-04-23 US disclosed
EP-0653426-A1 Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same KOWA COMPANY, LTD. (JP) 1995-05-17 EP disclosed