SCHEMBL20198315

SCHEMBL20198315

N=C1Cc2ccccc2-c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.46
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP2 O95551 1/20 0.43
CASP3 P42574 1/20 0.43
CASP7 P55210 1/20 0.43
CASP9 P55211 1/20 0.43
CASP6 P55212 1/20 0.43
CASP8 Q14790 1/20 0.43
MAP3K14 Q99558 1/20 0.43
CES1 P23141 2/20 0.43
BCHE P06276 1/20 0.43
PNMT P11086 1/20 0.39
SRD5A2 P31213 1/20 0.38

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
SCHEMBL27726559 0.90
SCHEMBL6481957 0.81 MAOA (0.65) MAOAALDH1A1KDM4ENPC1LMNA
Fluorene SCHEMBL19516585 0.81 MAOA (0.65) MAOAALDH1A1KDM4ENPC1LMNA
SCHEMBL3385148 0.81 MAOA (0.38) MAOAALDH1A1KDM4ENPC1LMNA
Fluorene SCHEMBL17107853 0.81 MAOA (0.65) MAOAALDH1A1KDM4ENPC1LMNA
Fluorene SCHEMBL14575480 0.78 MAOA (0.62) MAOAALDH1A1KDM4ENPC1LMNA
Fluorene SCHEMBL28142478 0.78 MAOA (0.62) MAOAALDH1A1KDM4ENPC1LMNA
SCHEMBL14717729 0.78 MAOA (0.44) MAOAALDH1A1KDM4ENPC1LMNA
Fluorene SCHEMBL29355380 0.78 MAOA (0.68) MAOAALDH1A1KDM4ENPC1LMNA
Fluorene SCHEMBL545861 0.78 MAOA (0.68) MAOAALDH1A1KDM4ENPC1LMNA

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-1675930-B1 NEW MATERIALS FOR ELECTROLUMINESCENCE AND THE UTILIZATION THEREOF MERCK PATENT GMBH (DE) 2018-05-30 EP disclosed