SCHEMBL34461906

SCHEMBL34461906

COc1cc(O)c(CC=C(C)C)c2c1[C@H](O)[C@H](OC)[C@@H](c1ccc(O)cc1)O2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 4/20 0.56
▸ AKR1B10 O60218 2/20 0.56
▸ AKR1B1 P15121 2/20 0.56
▸ PDPK1 O15530 2/20 0.56
▸ PRKCA P17252 1/20 0.56
▸ BACE1 P56817 1/20 0.56
▸ PRKCQ Q04759 1/20 0.56
▸ ABCG2 Q9UNQ0 3/20 0.47
▸ ESR2 Q92731 2/20 0.47
▸ MAOA P21397 2/20 0.47
▸ CACNA1G O43497 2/20 0.47
▸ CACNA1H O95180 2/20 0.47
▸ PDE5A O76074 1/20 0.47
▸ PDCD1 Q15116 1/20 0.45
▸ CD274 Q9NZQ7 1/20 0.45
▸ CYP19A1 P11511 1/20 0.44
▸ MAPT P10636 2/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44
▸ SENP6 Q9GZR1 1/20 0.44

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
SCHEMBL27006405 0.81 ESR1 (0.68) ESR1AKR1B10AKR1B1PDPK1PRKCA
SCHEMBL27013475 0.81 ESR1 (0.68) ESR1AKR1B10AKR1B1PDPK1PRKCA
Neophellamuretin SCHEMBL30766255 0.73 ABCG2 (0.66) ESR1AKR1B10AKR1B1PDPK1PRKCA
Neophellamuretin SCHEMBL27013455 0.73 ABCG2 (0.66) ESR1AKR1B10AKR1B1PDPK1PRKCA
Isoxanthohumol SCHEMBL14092988 0.72 ESR1 (1.00) ESR1AKR1B10AKR1B1PDPK1PRKCA
Isoxanthohumol SCHEMBL29743582 0.72 ESR1 (1.00) ESR1AKR1B10AKR1B1PDPK1PRKCA
Isoxanthohumol SCHEMBL30033683 0.72 ESR1 (1.00) ESR1AKR1B10AKR1B1PDPK1PRKCA
Isoxanthohumol SCHEMBL30034254 0.72 ESR1 (1.00) ESR1AKR1B10AKR1B1PDPK1PRKCA
Isoxanthohumol SCHEMBL904557 0.72 ESR1 (1.00) ESR1AKR1B10AKR1B1PDPK1PRKCA
Munduleaflavanone B SCHEMBL14049994 0.69 ESR1 (0.87) ESR1AKR1B10AKR1B1PDPK1PRKCA

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-121844939-A Method for improving flavonoid substances in suaeda salsa root system secretion by saline-alkali stress and application 中国科学院遗传与发育生物学研究所农业资源研究中心 2026-04-14 — — CN disclosed
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