SCHEMBL21131933

SCHEMBL21131933

c1ccc(-c2cc(-c3ccc(-c4c(-c5ccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cc5)ccc5ccccc45)cc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.54
KMT2A Q03164 9/20 0.54
HPGD P15428 9/20 0.54
ALDH1A1 P00352 8/20 0.54
MAPT P10636 8/20 0.54
NTSR1 P30989 1/20 0.50
KDM4E B2RXH2 5/20 0.48
LMNA P02545 3/20 0.48
GLA P06280 1/20 0.48
CYP1A1 P04798 1/20 0.46
CYP1B1 Q16678 1/20 0.46
ADORA2A P29274 2/20 0.44
ADORA1 P30542 2/20 0.44
ACACA Q13085 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
BRD4 O60885 1/20 0.40

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
SCHEMBL22056418 1.00 MEN1 (0.54) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL21159754 1.00 MEN1 (0.54) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL21131935 1.00 MEN1 (0.54) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL26509517 0.98 MEN1 (0.53) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL26509516 0.98 MEN1 (0.53) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL18965351 0.95 MEN1 (0.56) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL26509526 0.94 MEN1 (0.49) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL21131886 0.94 MEN1 (0.54) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL21131937 0.94 MEN1 (0.54) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL18965347 0.94 MEN1 (0.54) MEN1KMT2AHPGDALDH1A1MAPT

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-11211563-B2 Organic light emitting device LG CHEM, LTD. (KR) 2021-12-28 US disclosed
US-20190198766-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2019-06-27 US disclosed