SCHEMBL30646354

SCHEMBL30646354

CCOC(=O)/C=C/c1ccc(/C(=C(/CC)c2ccc(N(C)c3ccccc3)cc2)c2ccc3c(cnn3C3CCCCO3)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 17/20 0.49
▸ RXRA P19793 1/20 0.41
▸ RXRB P28702 1/20 0.41
▸ RXRG P48443 1/20 0.41
▸ MGLL Q99685 1/20 0.40
▸ PGR P06401 1/20 0.38
▸ ESR2 Q92731 1/20 0.38

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
SCHEMBL770766 0.94 ESR1 (0.55) ESR1RXRARXRBRXRGMGLL
SCHEMBL796325 0.92 ESR1 (0.58) ESR1RXRARXRBRXRGPGR
SCHEMBL796327 0.92 ESR1 (0.58) ESR1RXRARXRBRXRGPGR
SCHEMBL796326 0.92 ESR1 (0.58) ESR1RXRARXRBRXRGPGR
SCHEMBL796324 0.92 ESR1 (0.58) ESR1RXRARXRBRXRGPGR
SCHEMBL5019877 0.89 ESR1 (0.47) ESR1RXRARXRBRXRGMGLL
SCHEMBL15236144 0.89 ESR1 (0.47) ESR1RXRARXRBRXRGMGLL
SCHEMBL770771 0.87 ESR1 (0.47) ESR1RXRARXRBRXRGMGLL
SCHEMBL30646350 0.87 ESR1 (0.47) ESR1RXRARXRBRXRGMGLL
SCHEMBL15236145 0.86 RXRA (0.46) ESR1RXRARXRBRXRGMGLL

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
EP-2735562-B2 Estrogen receptor modulators and uses thereof SERAGON PHARMACEUTICALS INC (US) 2023-11-15 — — EP disclosed
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