SCHEMBL25401765

SCHEMBL25401765

c1ccc2c(-c3c(-c4cccc5c4ccc4ccccc45)ccc4ccccc34)cccc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 3/20 0.56
DNMT1 P26358 1/20 0.53
ALDH1A1 P00352 5/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP1A2 P05177 2/20 0.49
HPGD P15428 2/20 0.49
HIF1A Q16665 2/20 0.49
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX12 P18054 1/20 0.49
MAPK1 P28482 1/20 0.49
CYP2C19 P33261 1/20 0.49
HSD17B10 Q99714 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
CYP2A6 P11509 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL30021528 0.98 HPRT1 (0.54) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL30022344 0.98 DNMT1 (0.56) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL30022625 0.98 DNMT1 (0.56) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL25403069 0.98 DNMT1 (0.56) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL25401820 0.98 HPRT1 (0.58) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL25246791 0.96 HPRT1 (0.52) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL30332455 0.96 HPRT1 (0.52) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL30022080 0.96 HPRT1 (0.52) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL16700817 0.96 HPRT1 (0.56) HPRT1DNMT1ALDH1A1MEN1KMT2A
SCHEMBL25403049 0.96 HPRT1 (0.56) HPRT1DNMT1ALDH1A1MEN1KMT2A

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
WO-2023171544-A1 MIXED POWDER, METHOD FOR MANUFACTURING MIXED POWDER, COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT, AND METHOD FOR MANUFACTURING ORGANIC ELECTROLUMINESCENT ELEMENT 出光興産株式会社 2023-09-14 WO disclosed