SCHEMBL21757382

SCHEMBL21757382

Cc1cc(O)c(CO)cc1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SHBG P04278 1/20 0.44
▸ KLF10 Q13118 1/20 0.38
▸ PKM P14618 2/20 0.37
▸ ALOX15 P16050 2/20 0.35
▸ ALOX12 P18054 2/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ KDM4E B2RXH2 4/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ HPGD P15428 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ G6PD P11413 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL31413681 0.84 SHBG (0.39) SHBGALOX15ALOX12PTPN1ESR1
SCHEMBL24698730 0.84 SHBG (0.39) SHBGALOX15ALOX12PTPN1ESR1
SCHEMBL16736925 0.83 MCL1 (0.47) SHBGALOX15ALOX12PTPN1ESR1
SCHEMBL14924927 0.82 SHBG (0.42) SHBGPKMESR1ESR2KDM4E
SCHEMBL6828121 0.82 SHBG (0.38) SHBGALOX15ALOX12ESR1ESR2
SCHEMBL17930510 0.81 SHBG (0.34) SHBGPTPN1KDM4EALDH1A1HPGD
SCHEMBL5075167 0.79 SHBG (0.54) SHBGKLF10PKMALOX15ALOX12
SCHEMBL14283762 0.79 KDM4E (0.50) SHBGKLF10PKMALOX15ALOX12
SCHEMBL16736683 0.79 HMGCR (0.48) ALOX15ALOX12PTPN1ESR1ESR2
SCHEMBL17244912 0.77 SHBG (0.42) SHBGPKMALOX15KDM4EALDH1A1

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-3842410-A1 FIBRIC ACID COMPOUND AND MEDICAL USE THEREOF Beijing Wholesomeyird Sci & Tech Co., Ltd. (CN) 2021-06-30 — — EP disclosed
WO-2020038464-A1 FIBRIC ACID COMPOUND AND MEDICAL USE THEREOF 北京厚燊药德科技有限责任公司 2020-02-27 — — WO disclosed
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