SCHEMBL30968707

SCHEMBL30968707

CCOC(=O)c1cccc(C)c1C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.68
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
ALDH1A1 P00352 4/20 0.58
HSD17B10 Q99714 1/20 0.58
CA12 O43570 3/20 0.53
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
CA7 P43166 3/20 0.53
CA9 Q16790 3/20 0.53
CA14 Q9ULX7 3/20 0.53
CDC25B P30305 3/20 0.53
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.50
CYP2D6 P10635 1/20 0.50
GAA P10253 3/20 0.49
MAPT P10636 3/20 0.49
RAB9A P51151 2/20 0.49
POLB P06746 1/20 0.49
PKM P14618 1/20 0.49

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
SCHEMBL574192 1.00 TSHR (0.68) TSHRMEN1KMT2AALDH1A1HSD17B10
Ammonia Solution, Strong SCHEMBL29087129 0.98 TSHR (0.66) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL17788974 0.89 KMT2A (0.57) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL16051215 0.87 ALDH1A1 (0.68) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL998093 0.85 KMT2A (0.55) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL16051405 0.84 TSHR (0.70) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL29535471 0.84 TSHR (0.80) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL1569293 0.84 TSHR (0.80) TSHRMEN1KMT2AALDH1A1HSD17B10
Bisphenol A SCHEMBL31704668 0.84 TSHR (0.49) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL29498476 0.84 MEN1 (0.54) TSHRMEN1KMT2AALDH1A1HSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122070275-A Heterocyclic compound and application thereof 成都麻沸散医药科技有限公司 2026-05-19 CN disclosed
CN-118240886-A Method for synthesizing ethyl salicylate compound by biological enzyme catalysis 济南大学 2024-06-25 CN disclosed