SCHEMBL28107125

SCHEMBL28107125

CCCCCCCCCCCCCCCc1cccc(-c2ccc(O)cc2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 4/20 0.61
▸ ESR1 P03372 3/20 0.61
▸ ADRA2A P08913 2/20 0.61
▸ ADORA3 P0DMS8 2/20 0.61
▸ TACR2 P21452 2/20 0.61
▸ SLC6A2 P23975 2/20 0.61
▸ SLC6A4 P31645 2/20 0.61
▸ SLC6A3 Q01959 2/20 0.61
▸ CYP3A4 P08684 2/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ LMNA P02545 1/20 0.61
▸ SHBG P04278 1/20 0.61
▸ TP53 P04637 1/20 0.61
▸ HSPD1 P10809 1/20 0.61
▸ ADRB3 P13945 1/20 0.61
▸ HTR2C P28335 1/20 0.61
▸ HSPE1 P61604 1/20 0.61
▸ HIF1A Q16665 1/20 0.61
▸ TST Q16762 1/20 0.61

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
SCHEMBL28085352 0.98 PTGS2 (0.58) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL1513699 0.93 MMP3 (0.54) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL28079356 0.88 LPL (0.61) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL27694667 0.86 LPL (0.56) LPLLIPG
SCHEMBL3126881 0.86 LPL (0.56) LPLLIPG
SCHEMBL8558569 0.86 MMP3 (0.57) ESR1CYP3A4MMP3MEN1KMT2A
SCHEMBL9658657 0.86 LPL (0.59) PTGS2CYP3A4LPLLIPG
SCHEMBL6059834 0.84 LPL (0.54) LPLLIPG
SCHEMBL28348149 0.84 PTGS2 (0.61) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL28351682 0.84 PTGS2 (0.61) PTGS2ESR1ADRA2AADORA3TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103484191-B It is prepared by phenate detergents 英菲诺姆国际有限公司 2017-12-05 — — CN claimed
CN-107207718-B Preparation of highly heat-resistant (co) polycarbonates by the transesterification process 科思创德国股份有限公司 2019-12-03 — — CN disclosed
CN-107207718-A Preparation of highly heat-resistant (co) polycarbonates by the transesterification process 科思创德国股份有限公司 2017-09-26 — — CN disclosed
CN-106133058-A Polycarbonate resin composition and molded article 出光兴产株式会社 2016-11-16 — — CN disclosed
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