SCHEMBL10341264

SCHEMBL10341264

O=C(O)c1ccc(C(c2ccccc2Oc2ccccc2)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 9/20 0.47
▸ LPAR5 Q9H1C0 9/20 0.47
▸ SRD5A2 P31213 4/20 0.46
▸ RXRA P19793 1/20 0.46
▸ RXRB P28702 1/20 0.46
▸ RXRG P48443 1/20 0.46
▸ TTR P02766 2/20 0.46
▸ RORC P51449 1/20 0.41
▸ MAPK14 Q16539 1/20 0.40

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
SCHEMBL8473901 0.83 POLB (0.41) TTR
SCHEMBL10391880 0.81 MAOA (0.46) —
SCHEMBL1636048 0.79 PARP15 (0.55) SRD5A2RXRARXRBRXRGMAPK14
SCHEMBL9740386 0.79 PARP15 (0.55) SRD5A2RXRARXRBRXRGMAPK14
SCHEMBL9290961 0.77 SRD5A2 (0.55) SRD5A2RXRARXRBRXRG
SCHEMBL10390912 0.75 MAOA (0.46) —
SCHEMBL16429183 0.75 AKR1C3 (0.62) SRD5A2MAPK14
SCHEMBL8746030 0.75 RXRA (0.62) LPAR1LPAR5SRD5A2RXRARXRB
SCHEMBL8921736 0.75 PARP15 (0.50) SRD5A2RXRARXRBRXRGMAPK14
SCHEMBL336470 0.75 SRD5A2 (0.61) SRD5A2RXRARXRBRXRG

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-0317940-A3 POLYCARBONAMIDES OF BIS (2-(4-CARBOXYPHENYL)HEXAFLUOROISOPROPYL) - DIPHENYL ETHER HOECHST CELANESE CORPORATION (US) 1990-02-28 — — EP disclosed
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