SCHEMBL28601374

SCHEMBL28601374

CC(Cc1ccccc1O)c1ccc(C(C)Cc2ccccc2O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 2/20 0.48
▸ ESR2 Q92731 2/20 0.48
▸ HSPA5 P11021 1/20 0.48
▸ CYP2D6 P10635 4/20 0.46
▸ SLC6A2 P23975 4/20 0.46
▸ SLC6A4 P31645 4/20 0.46
▸ SLC6A3 Q01959 4/20 0.46
▸ CYP3A4 P08684 3/20 0.46
▸ KCNH2 Q12809 2/20 0.46
▸ TSHR P16473 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HIF1A Q16665 1/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.42
▸ GABRA1 P14867 1/20 0.42
▸ GABRB2 P47870 1/20 0.42
▸ AKR1B1 P15121 1/20 0.42
▸ IDO1 P14902 1/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA2 P00918 1/20 0.41

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
SCHEMBL10706145 0.94 ESR1 (0.58) ESR1ESR2HSPA5CYP2D6SLC6A2
SCHEMBL1952363 0.94 SLC6A2 (0.47) ESR1ESR2HSPA5CYP2D6SLC6A2
SCHEMBL25215353 0.94 SLC6A2 (0.47) ESR1ESR2HSPA5CYP2D6SLC6A2
SCHEMBL10335147 0.87 CYP3A4 (0.44) ESR1CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL30477717 0.86 HDAC4 (0.49) HSPA5CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL7164202 0.86 HDAC4 (0.49) HSPA5CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL10617353 0.83 TSHR (0.55) HSPA5CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL2472270 0.83 ESR1 (0.64) ESR1ESR2CYP2D6SLC6A2SLC6A3
SCHEMBL30394315 0.83 ESR1 (0.64) ESR1ESR2CYP2D6SLC6A2SLC6A3
SCHEMBL188373 0.82 TSHR (0.64) HSPA5CYP2D6SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119998360-A Thermoplastic resin and molded body comprising thermoplastic resin 三菱瓦斯化学株式会社 2025-05-13 — — CN disclosed
CN-115698110-B Resin composition for curing, molded article, and method for producing same 三菱瓦斯化学株式会社 2025-04-29 — — CN disclosed
CN-119053452-A Thermosensitive recording medium 王子控股株式会社 2024-11-29 — — CN disclosed
CN-118973826-A Thermosensitive recording medium 王子控股株式会社 2024-11-15 — — CN disclosed
CN-111848940-B Polycarbonate polyol compositions and methods 沙特阿美技术公司 2024-09-06 — — CN disclosed
CN-114466877-B Resin composition for curing, method for curing the same, and molded article 三菱瓦斯化学株式会社 2024-05-14 — — CN disclosed
CN-118043369-A Thermosetting resin, composition, uncured molded article, partially cured molded article, and method for producing thermosetting resin 株式会社钟化 2024-05-14 — — CN disclosed
CN-117957123-A Thermosensitive recording medium 王子控股株式会社 2024-04-30 — — CN disclosed
CN-113166029-B Process for preparing carbonate derivatives 国立大学法人神户大学 2023-11-21 — — CN disclosed
CN-116888215-A Polycarbonate resin composition 三菱瓦斯化学株式会社 2023-10-13 — — CN disclosed
CN-116490375-A Thermosensitive recording medium 王子控股株式会社 2023-07-25 — — CN disclosed
CN-113166392-B Process for the preparation of polycarbonates 国立大学法人神户大学 2023-07-14 — — CN disclosed
CN-116438240-A Resin composition, and coating film and electrolyte using the same 三菱瓦斯化学株式会社 2023-07-14 — — CN disclosed
CN-111171545-B Polycarbonate resin composition, method for producing same, and molded article 三菱化学株式会社 2023-04-28 — — CN disclosed
CN-113166392-A Process for the preparation of polycarbonates 国立大学法人神户大学 2021-07-23 — — CN disclosed
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