SCHEMBL3915772

SCHEMBL3915772

Cc1cc(O)c(C)c(Br)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.65
SELL P14151 1/20 0.50
SELP P16109 1/20 0.50
SELE P16581 1/20 0.50
TRPA1 O75762 2/20 0.40
ALDH1A1 P00352 4/20 0.39
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
CYP3A4 P08684 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
APEX1 P27695 1/20 0.37
MPI P34949 1/20 0.37
RECQL P46063 1/20 0.37
ALOX15 P16050 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL31090217 1.00 ACHE (0.65) ACHESELLSELPSELETRPA1
SCHEMBL69718 0.80 ACHE (1.00) ACHESELLSELPSELETRPA1
SCHEMBL5778579 0.80 ACHE (0.40) ACHESELLSELPSELEALDH1A1
SCHEMBL11136759 0.79 CYP3A4 (0.50) ACHEESR1ESR2CYP3A4MAPT
SCHEMBL11418582 0.79 SELL (0.65) ACHESELLSELPSELETRPA1
SCHEMBL22112316 0.76 ACHE (0.46) ACHESELLSELPSELEALDH1A1
SCHEMBL24701452 0.75 GAA (0.46) ACHEALDH1A1ESR2CYP3A4KDM4E
SCHEMBL22265090 0.75 ALDH1A1 (0.41) ACHEALDH1A1CYP3A4MAPTKMT2A
SCHEMBL21614390 0.75 SELL (0.46) ACHESELLSELPSELETRPA1
SCHEMBL22690036 0.75 ACHE (0.40) ACHEALDH1A1CYP3A4MAPTKMT2A

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 5 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
EP-2024353-A2 PYRAZOLE COMPOUNDS Pfizer Products Inc. (US) 2009-02-18 EP disclosed
WO-2007105058-A2 PYRAZOLE COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-09-20 WO disclosed
WO-2007105058-A2 PYRAZOLE COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-09-20 WO disclosed