SCHEMBL30692007

SCHEMBL30692007

c1ccc2c(-c3ccc4ccccc4c3-c3c(-c4cccc5ccccc45)ccc4ccccc34)cccc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.61
ALDH1A1 P00352 7/20 0.50
HSD17B10 Q99714 4/20 0.50
CYP2A6 P11509 2/20 0.50
TSHR P16473 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
MAPT P10636 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HPRT1 P00492 1/20 0.46
CES1 P23141 1/20 0.46
GPR84 Q9NQS5 1/20 0.45
CYP1A2 P05177 3/20 0.42
HPGD P15428 3/20 0.42
HIF1A Q16665 2/20 0.42
CYP1B1 Q16678 1/20 0.42
THRB P10828 1/20 0.42
WDR5 P61964 1/20 0.42

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
SCHEMBL29787010 0.93 DNMT1 (0.59) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL29410608 0.93 DNMT1 (0.59) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL196007 0.93 DNMT1 (0.59) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL31307687 0.91 DNMT1 (0.57) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL29810649 0.91 DNMT1 (0.57) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL14777719 0.90 DNMT1 (0.64) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL9099488 0.90 DNMT1 (0.52) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL30021600 0.89 HPRT1 (0.58) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL25404732 0.88 DNMT1 (0.55) DNMT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL30332848 0.88 DNMT1 (0.55) DNMT1ALDH1A1HSD17B10CYP2A6TSHR

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-117321115-A Polyether resin, process for producing the same, and use thereof 大阪燃气化学有限公司 2023-12-29 CN disclosed