SCHEMBL12021032

SCHEMBL12021032

COc1cc2c(cc1C)CCN(C)C2Cc1ccc(C)cc1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.70
▸ KDM4E B2RXH2 2/20 0.70
▸ ALDH1A1 P00352 2/20 0.70
▸ HSD17B10 Q99714 2/20 0.70
▸ MAPK1 P28482 1/20 0.70
▸ CYP2D6 P10635 1/20 0.70
▸ ALOX15 P16050 1/20 0.69
▸ KCNH2 Q12809 2/20 0.60
▸ DRD2 P14416 1/20 0.60
▸ DRD1 P21728 1/20 0.60
▸ KMT2A Q03164 1/20 0.58

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
SCHEMBL12345941 0.84 LMNA (0.83) LMNAKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL12807818 0.82 LMNA (0.81) LMNAKDM4EALDH1A1HSD17B10MAPK1
Laudanosine SCHEMBL466529 0.82 LMNA (1.00) LMNAKDM4EALDH1A1HSD17B10MAPK1
Laudanosine SCHEMBL6130845 0.82 LMNA (1.00) LMNAKDM4EALDH1A1HSD17B10MAPK1
Laudanosine SCHEMBL30816021 0.82 LMNA (1.00) LMNAKDM4EALDH1A1HSD17B10MAPK1
Laudanosine SCHEMBL29822950 0.82 LMNA (1.00) LMNAKDM4EALDH1A1HSD17B10MAPK1
Laudanosine SCHEMBL466528 0.82 LMNA (1.00) LMNAKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL20170794 0.81 DRD2 (0.67) LMNAKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL1389166 0.81 KDM4E (1.00) LMNAKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL29202140 0.81 KDM4E (1.00) LMNAKDM4EALDH1A1HSD17B10MAPK1

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
EP-1774968-B1 PSYCOTHROPIC AGENT AND HEALTH FOOD CONTAINING NEFERINE INST OF ORIENTAL MEDICAL SCIENCE INC (JP) 2011-12-21 — — EP disclosed
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