SCHEMBL24728629

SCHEMBL24728629

In1c2ccc(-c3ccccc3)cc2c2c3c(ccc21)oc1ccccc13

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 5/20 0.45
PLA2G4A P47712 5/20 0.45
PLA2G10 O15496 1/20 0.40
PRKDC P78527 3/20 0.37
CASP3 P42574 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
NPC1 O15118 2/20 0.35
HPGD P15428 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
CA12 O43570 1/20 0.35
TNKS O95271 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
TP53 P04637 1/20 0.35
ABCB1 P08183 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL24403680 0.84 MAOA (0.38) PRKDCNPC1HPGDRAB9ASMN1; SMN2
SCHEMBL25612911 0.83 PLA2G2A (0.45) PLA2G2APLA2G4APLA2G10PRKDCCASP3
SCHEMBL25678721 0.82 MAOB (0.40) NPC1HPGDRAB9ASMN1; SMN2TNKS
SCHEMBL25678770 0.81 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10PRKDCNPC1
SCHEMBL24676181 0.80 KDM4E (0.42) PLA2G2APLA2G4APLA2G10PRKDCCASP3
SCHEMBL19652779 0.79 KDM4E (0.41) PLA2G2APLA2G4APLA2G10PRKDCCASP3
SCHEMBL16804603 0.79 PLA2G2A (0.55) PLA2G2APLA2G4APLA2G10PRKDCCASP3
SCHEMBL17760770 0.78 L3MBTL1 (0.44) PLA2G2APLA2G4APLA2G10PRKDCKDM4E
SCHEMBL17691767 0.78 KDM4E (0.41) PLA2G2APLA2G4APLA2G10PRKDCCASP3
SCHEMBL19652730 0.78 L3MBTL1 (0.44) PLA2G2APLA2G4APLA2G10PRKDCKDM4E

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-4102588-A1 HOST MATERIAL, COMPOSITION, AND ORGANIC ELECTROLUMINESCENT ELEMENT Kyulux, Inc. (JP) 2022-12-14 EP disclosed