SCHEMBL15071292

SCHEMBL15071292

CCC1(CC)c2ccccc2C(CC)(CC)N1C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
ELANE P08246 2/20 0.33
CYP2C19 P33261 2/20 0.32
TSHR P16473 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
CYP1A2 P05177 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
CYP2D6 P10635 1/20 0.32
PGR P06401 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL29728008 0.78 CYP1A2 (0.34) ALDH1A1ELANECYP2C19CYP1A2KMT2A
SCHEMBL325978 0.78 CYP1A2 (0.34) ALDH1A1ELANECYP2C19CYP1A2KMT2A
SCHEMBL6872631 0.78 ALDH1A1 (0.41) ALDH1A1ELANECYP2C19CYP1A2KMT2A
SCHEMBL11716102 0.75 PKM (0.35) ELANECYP2C19TSHRSIGMAR1CYP1A2
SCHEMBL18217969 0.75 PKM (0.33) ALDH1A1ELANELMNA
SCHEMBL15069963 0.75 ALDH1A1 (0.32) ALDH1A1ELANE
SCHEMBL4986806 0.73 SLC6A3 (0.40) SIGMAR1LMNA
SCHEMBL1297947 0.72 ELANE (0.46) ALDH1A1ELANECYP2C19SIGMAR1LMNA
SCHEMBL4988366 0.69 CYP2B6 (0.39) ALDH1A1ELANECYP2C19
SCHEMBL16435108 0.69

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-8557927-B2 Comb-shaped graft copolymers and methods of manufacturing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-10-15 US disclosed
US-20130165592-A1 COMB-SHAPED GRAFT COPOLYMERS AND METHODS OF MANUFACTURING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-06-27 US disclosed