SCHEMBL24586441

SCHEMBL24586441

c1ccc(-c2cccc(-c3nc(-c4ccc5cc(-c6ccccc6)ccc5c4)nc(-c4cccc5c4oc4c6ccccc6c(-c6ccccc6)cc54)n3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ PRKDC P78527 4/20 0.35
▸ PGR P06401 1/20 0.35
▸ PLA2G2A P14555 1/20 0.35
▸ PLA2G4A P47712 1/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ TP53 P04637 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ACACA Q13085 1/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ PIK3CD O00329 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
SCHEMBL24585703 0.94 ALDH1A1 (0.42) ESR1ESR2PRKDCPGRCYP11B1
SCHEMBL24585561 0.94 ALDH1A1 (0.40) PRKDCALDH1A1KDM4ETP53SMN1; SMN2
SCHEMBL24586700 0.93 PRKDC (0.39) ESR1ESR2PRKDCCYP11B1CYP11B2
SCHEMBL24585524 0.92 ALDH1A1 (0.43) PRKDCALDH1A1KDM4ETP53SMN1; SMN2
SCHEMBL24586662 0.91 ALOX5 (0.38) ESR1ESR2PGRPLA2G2APLA2G4A
SCHEMBL24586748 0.90 ALDH1A1 (0.41) ESR1ESR2PRKDCCYP11B1CYP11B2
SCHEMBL26244744 0.90 PRKDC (0.41) PRKDCALDH1A1KDM4ETP53SMN1; SMN2
SCHEMBL24030647 0.89 ALDH1A1 (0.35) ESR1ESR2PRKDCPGRALDH1A1
SCHEMBL24703261 0.89 PRKDC (0.41) PRKDCPLA2G2APLA2G4AALDH1A1KDM4E
SCHEMBL23034384 0.88 PRKDC (0.42) PRKDCPLA2G2APLA2G4AALDH1A1KDM4E

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-4019505-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME, METHOD FOR MANUFACTURING THE SAME AND COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT EMITTING DEVICE LT Materials Co., Ltd. (KR) 2022-06-29 — — EP disclosed
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