SCHEMBL25549673

SCHEMBL25549673

O=C1c2ccccc2C(=O)N1Cc1cnc2ncccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ UBE2N P61088 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ MAPK1 P28482 2/20 0.48
▸ PABPC1 P11940 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ CYP1B1 Q16678 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ CASP3 P42574 1/20 0.45
▸ HPGD P15428 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43

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
SCHEMBL18529278 0.82 CYP1B1 (0.49) KMT2AMEN1ALDH1A1PKMKDM4E
SCHEMBL1163336 0.80 CYP1B1 (0.69) KMT2AMEN1ALDH1A1PKMKDM4E
SCHEMBL30116791 0.74 KMT2A (0.55) KMT2AMEN1ALDH1A1PKMKDM4E
SCHEMBL2418409 0.74 KMT2A (0.55) KMT2AMEN1ALDH1A1PKMKDM4E
SCHEMBL2569297 0.73 PABPC1 (0.60) KMT2AMEN1ALDH1A1PKMKDM4E
SCHEMBL21528071 0.72 CASP3 (0.57) KMT2AMEN1ALDH1A1PKMKDM4E
SCHEMBL45682 0.72 KDM4E (0.75) KMT2AMEN1ALDH1A1KDM4EUBE2N
SCHEMBL17029125 0.72 CASP3 (0.66) KMT2AMEN1ALDH1A1PKMMAPK1
SCHEMBL28438167 0.72 ACP1 (0.40) ALDH1A1KDM4EALOX15MAPTHTT
SCHEMBL10077023 0.72 PARP1 (0.49) ALDH1A1CYP1A2

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-3246963-B1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2023-05-31 — — EP disclosed
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