SCHEMBL20153536

SCHEMBL20153536

CC(C)(C)Oc1ccc(C(=O)c2ccc(Oc3ccc(-c4ccc(C(C)(C)C(C)(O)Oc5ccc(C(=O)c6ccc(Oc7ccc(C(C)(C)C)cc7)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 1/20 0.43
▸ SIRT1 Q96EB6 1/20 0.43
▸ FGFR2 P21802 1/20 0.40
▸ TRPV1 Q8NER1 2/20 0.40
▸ CNR1 P21554 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ FABP1 P07148 1/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ RECQL P46063 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
SCHEMBL19542245 0.91 SRD5A2 (0.51) SRD5A2SIRT1FGFR2TRPV1CNR1
SCHEMBL13064135 0.91 SRD5A2 (0.51) SRD5A2SIRT1FGFR2TRPV1CNR1
SCHEMBL20153512 0.89 SRD5A2 (0.44) SRD5A2SIRT1FGFR2TRPV1CNR1
SCHEMBL18635899 0.87 SRD5A2 (0.56) SRD5A2SIRT1FGFR2TRPV1ALDH1A1
SCHEMBL22295619 0.87 SRD5A2 (0.56) SRD5A2SIRT1FGFR2TRPV1ALDH1A1
SCHEMBL22538881 0.87 SRD5A2 (0.56) SRD5A2SIRT1FGFR2TRPV1ALDH1A1
SCHEMBL12598675 0.87 SRD5A2 (0.56) SRD5A2SIRT1FGFR2TRPV1ALDH1A1
SCHEMBL21515379 0.87 SRD5A2 (0.56) SRD5A2SIRT1FGFR2TRPV1ALDH1A1
SCHEMBL19353473 0.84 SIRT1 (0.47) SRD5A2SIRT1FGFR2TRPV1CNR1
SCHEMBL22892431 0.83 SRD5A2 (0.51) SRD5A2SIRT1FGFR2TRPV1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3538589-B1 POLYARYLETHER KETONE COPOLYMER SOLVAY SPECIALTY POLYMERS USA (US) 2021-10-20 — — EP disclosed
WO-2018086873-A1 POLYARYLETHER KETONE COPOLYMER SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2018-05-17 — — WO disclosed
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