SCHEMBL30945467

SCHEMBL30945467

c1ccc(N(c2ccccc2)c2ccc(Nc3ccc(-c4cccc5ccccc45)cc3)c(Nc3ccc(-c4cccc5ccccc45)cc3)c2Nc2ccc(-c3cccc4ccccc34)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
CDC25B P30305 1/20 0.40
ATM Q13315 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM1A O60341 3/20 0.40
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 2/20 0.37
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ENPP3 O14638 1/20 0.35
ENPP1 P22413 1/20 0.35
MAPT P10636 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 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
SCHEMBL19738510 0.79 ALDH1A1 (0.45) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL5049500 0.78 HSD17B10 (0.47) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL13374612 0.77 CDC25B (0.51) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL13374615 0.77 CDC25B (0.51) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL21185707 0.76 CA12 (0.41) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL13903705 0.76 ALDH1A1 (0.56) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL4580402 0.76 ALDH1A1 (0.49) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL24154501 0.74 CA12 (0.45) ALDH1A1TP53HPGDTSHRATM
SCHEMBL13374608 0.74 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL18655635 0.74 ALDH1A1 (0.58) ALDH1A1TP53CYP3A4HPGDALOX15

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
CN-118265332-A Light emitting device and electronic apparatus including the same TCL科技集团股份有限公司 2024-06-28 CN claimed