SCHEMBL2159155

SCHEMBL2159155

O=C1c2ccc3c4c(ccc(c24)C(=O)N1C1CCCCC1)CC3

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.49
KDM4E B2RXH2 7/20 0.47
HPGD P15428 7/20 0.47
HSD17B10 Q99714 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TDP1 Q9NUW8 3/20 0.44
CYP1A2 P05177 2/20 0.44
POLB P06746 2/20 0.44
CYP2C19 P33261 2/20 0.44
MAPK1 P28482 2/20 0.44
LMNA P02545 2/20 0.43
CYP2C9 P11712 1/20 0.43
RECQL P46063 1/20 0.43
GAA P10253 2/20 0.42
KMT2A Q03164 2/20 0.42
OPRM1 P35372 1/20 0.41
OPRK1 P41145 1/20 0.41
OPRL1 P41146 1/20 0.41

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
SCHEMBL10261468 0.89 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL10260482 0.89 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL12511989 0.87 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL822463 0.87 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL3170465 0.83 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL13526594 0.83 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL14075773 0.83 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL6266985 0.82 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL2861936 0.82 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL822758 0.80 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8309394-B2 Method of making N-type semiconductor devices EASTMAN KODAK COMPANY (US) 2012-11-13 US disclosed
US-8212243-B2 Organic semiconducting compositions and N-type semiconductor devices EASTMAN KODAK COMPANY (US) 2012-07-03 US disclosed
US-20110180784-A1 ORGANIC SEMICONDUCTING COMPOSITIONS AND N-TYPE SEMICONDUCTOR DEVICES BANK OF AMERICA, N.A., AS AGENT 2011-07-28 US disclosed
US-20110183462-A1 METHOD OF MAKING N-TYPE SEMICONDUCTOR DEVICES BANK OF AMERICA, N.A., AS AGENT 2011-07-28 US disclosed
WO-2011090953-A1 ORGANIC SEMICONDUCTING COMPOSITIONS AND N-TYPE SEMICONDUCTOR DEVICES EASTMAN KODAK COMPANY (US) 2011-07-28 WO disclosed