SCHEMBL25668151

SCHEMBL25668151

Cc1nc2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc2n1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
CYP1A2 P05177 3/20 0.51
PDE10A Q9Y233 3/20 0.51
ALDH1A1 P00352 1/20 0.49
PIK3CD O00329 3/20 0.47
PIK3CA P42336 3/20 0.47
MTOR P42345 3/20 0.47
HSD17B10 Q99714 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.43
HCAR1 Q9BXC0 1/20 0.39
AVPR1A P37288 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
SCHEMBL24812214 0.96 MAPK1 (0.49) MAPK1HTTCYP1A2PDE10AALDH1A1
SCHEMBL21515507 0.93 MAPK1 (0.50) MAPK1HTTCYP1A2PDE10AALDH1A1
SCHEMBL338566 0.91 ALDH1A1 (0.57) MAPK1HTTCYP1A2PDE10AALDH1A1
SCHEMBL12888168 0.88 ESR1 (0.47) HTTCYP1A2PDE10AALDH1A1KDM4E
SCHEMBL14499579 0.88 ALDH1A1 (0.53) MAPK1HTTCYP1A2PDE10AALDH1A1
SCHEMBL14499589 0.88 ALDH1A1 (0.53) MAPK1HTTCYP1A2PDE10AALDH1A1
SCHEMBL338222 0.87 MAPK1 (0.56) MAPK1HTTCYP1A2PDE10AALDH1A1
SCHEMBL19310492 0.87 MAPK1 (0.55) MAPK1HTTCYP1A2PDE10AALDH1A1
SCHEMBL17932824 0.87 MAPK1 (0.55) MAPK1HTTCYP1A2PDE10AALDH1A1
SCHEMBL14499592 0.86 ALDH1A1 (0.52) MAPK1HTTCYP1A2PDE10AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230209998-A1 ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2023-06-29 US disclosed
US-20230209998-A1 ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2023-06-29 US disclosed