SCHEMBL20923637

SCHEMBL20923637

N#Cc1cc(-c2ccccc2)c(-n2c3cc(-n4c5ccccc5c5ccccc54)ccc3c3ccc(-n4c5ccccc5c5ccccc54)cc32)cc1-c1ccncc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 1/20 0.38
SQOR Q9Y6N5 1/20 0.37
CYP2C19 P33261 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
METAP2 P50579 1/20 0.34
KDM4E B2RXH2 2/20 0.34
PDE3B Q13370 2/20 0.34
PDE3A Q14432 2/20 0.34
PDE5A O76074 1/20 0.34
TSHR P16473 1/20 0.34
PTGS1 P23219 1/20 0.34
PDE4A P27815 1/20 0.34
BLM P54132 1/20 0.34
PDE4B Q07343 1/20 0.34

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
SCHEMBL20923234 1.00 LMNA (0.38) LMNAHPGDALDH1A1SMN1; SMN2MAPK1
SCHEMBL20924103 0.96 SQOR (0.39) LMNAHPGDALDH1A1SMN1; SMN2MAPK1
SCHEMBL20923642 0.94 LMNA (0.38) LMNAHPGDALDH1A1SMN1; SMN2MAPK1
SCHEMBL20923244 0.94 LMNA (0.38) LMNAHPGDALDH1A1SMN1; SMN2MAPK1
SCHEMBL19908977 0.92 SQOR (0.36) LMNAHPGDALDH1A1SMN1; SMN2MAPK1
SCHEMBL19909489 0.92 SQOR (0.36) LMNAHPGDALDH1A1SMN1; SMN2MAPK1
SCHEMBL19919547 0.92 SQOR (0.36) LMNAHPGDALDH1A1SMN1; SMN2MAPK1
SCHEMBL19913100 0.92 SQOR (0.36) LMNAHPGDALDH1A1SMN1; SMN2MAPK1
SCHEMBL20923088 0.90 PIK3CA (0.41) LMNAHPGDSMN1; SMN2SQORCYP2C19
SCHEMBL20923078 0.89 CYP19A1 (0.39) LMNAHPGDALDH1A1SQORCYP2C19

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-3266772-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-24 EP disclosed