SCHEMBL29670086

SCHEMBL29670086

Clc1nc(-c2cc3ccccc3c3ccccc23)c2c(n1)oc1ccccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ HSD17B10 Q99714 3/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ AHR P35869 3/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ IGF1R P08069 3/20 0.34
▸ EGFR P00533 2/20 0.33
▸ FLT4 P35916 2/20 0.33
▸ KDR P35968 2/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ NISCH Q9Y2I1 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ GAA P10253 1/20 0.32

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
SCHEMBL17297493 1.00 HPGD (0.35) HPGDALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL17297597 0.84 ALDH1A1 (0.40) HPGDALDH1A1L3MBTL1HSD17B10TSHR
SCHEMBL24813637 0.83 SMN1; SMN2 (0.38) HPGDALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL17297495 0.83 L3MBTL1 (0.40) HPGDALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL17297447 0.81 ALDH1A1 (0.39) HPGDALDH1A1L3MBTL1IGF1REGFR
SCHEMBL17297404 0.80 ALDH1A1 (0.47) HPGDALDH1A1L3MBTL1IGF1REGFR
SCHEMBL17297628 0.80 TDP1 (0.36) HPGDALDH1A1L3MBTL1HSD17B10TSHR
SCHEMBL17297612 0.80 ALOX5 (0.42) HPGDALDH1A1HSD17B10AHRIGF1R
SCHEMBL17305864 0.78 ALDH1A1 (0.39) HPGDALDH1A1L3MBTL1AHRIGF1R
SCHEMBL17297367 0.78 SMN1; SMN2 (0.43) HPGDALDH1A1L3MBTL1AHRSMN1; SMN2

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-110099895-B Compound and organic light emitting diode comprising same 株式会社LG化学 2022-05-31 — — CN disclosed
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