SCHEMBL7526068

SCHEMBL7526068

CCCC(C)(C)C1CCCCCCCCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
ALOX12 P18054 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SHBG P04278 1/20 0.32
CHRM2 P08172 1/20 0.31
CYP2D6 P10635 1/20 0.31
CHRM1 P11229 1/20 0.31
KCNH2 Q12809 1/20 0.31
SSTR4 P31391 1/20 0.31
CNR1 P21554 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
SCHEMBL10387752 1.00 CYP1A2 (0.41) CYP1A2MEN1ALDH1A1LMNAALOX12
SCHEMBL20350217 0.97 CYP1A2 (0.37) CYP1A2MEN1ALDH1A1LMNAALOX12
SCHEMBL1128180 0.82 CYP1A2 (0.45) CYP1A2CNR1
SCHEMBL5171549 0.81 CYP1A2 (0.43) CYP1A2MEN1ALDH1A1LMNAALOX12
SCHEMBL2991590 0.80 CYP1A2 (0.41) CYP1A2MEN1ALDH1A1LMNAALOX12
SCHEMBL1396813 0.79 ALDH1A1 (0.39) CYP1A2MEN1ALDH1A1LMNAALOX12
SCHEMBL25418137 0.78 MEN1 (0.36) CYP1A2MEN1ALDH1A1LMNAALOX12
SCHEMBL2777672 0.78 MEN1 (0.40) CYP1A2MEN1ALDH1A1LMNAALOX12
SCHEMBL6491689 0.78 MEN1 (0.36) CYP1A2MEN1ALDH1A1LMNAALOX12
SCHEMBL20012662 0.78 GNAO1 (0.34) MEN1LMNAKMT2ACYP2D6KCNH2

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
US-20020016418-A1 Curable coating compositions and methods of forming coating films KANSAI PAINT CO., LTD. (JP) 2002-02-07 US disclosed