SCHEMBL20842250

SCHEMBL20842250

CCN1CCC(C2=CC=C(/C(=C(/CCCO)C3=CCCC=C3)c3cccc(O)c3)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ESRRG P62508 18/20 0.51
▸ ESRRB O95718 7/20 0.43
▸ KCNH2 Q12809 4/20 0.38
▸ ESR1 P03372 8/20 0.37
▸ HTR1A P08908 2/20 0.32
▸ DRD1 P21728 2/20 0.32
▸ DRD4 P21917 2/20 0.32
▸ DRD5 P21918 2/20 0.32
▸ DRD3 P35462 2/20 0.32
▸ DRD2 P14416 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
SCHEMBL24505518 0.86 ESRRG (0.51) ESRRGESRRBKCNH2ESR1HTR1A
SCHEMBL20842009 0.84 ESRRG (0.73) ESRRGESRRBKCNH2ESR1
SCHEMBL24354543 0.78 ESRRG (0.70) ESRRGESRRBKCNH2ESR1
SCHEMBL24505410 0.75 ESRRG (0.56) ESRRGESRRBKCNH2ESR1
SCHEMBL20978458 0.72 ESRRG (0.75) ESRRGESRRBKCNH2ESR1
SCHEMBL20978521 0.71 ESRRG (0.58) ESRRGESRRBKCNH2ESR1
SCHEMBL20842131 0.70 ESRRG (0.73) ESRRGESRRBKCNH2ESR1
SCHEMBL24505447 0.70 ESRRG (0.73) ESRRGESRRBKCNH2ESR1
SCHEMBL24354544 0.70 ESRRG (0.64) ESRRGESRRBKCNH2ESR1
SCHEMBL24505508 0.69 ESRRG (0.77) ESRRGESRRBKCNH2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3480186-B1 NOVEL ARYL ETHENE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT NOVMETAPHARMA CO LTD (KR) 2022-06-15 — — EP disclosed
EP-3459936-B1 NOVEL ARYL ETHANE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT DAEGU GYEONGBUK MEDICAL INNOVATION FOUND (KR) 2022-04-27 — — EP disclosed
EP-3459936-A1 NOVEL ARYL ETHANE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT Kemimedi Co. Ltd (KR) 2019-03-27 — — EP disclosed
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