SCHEMBL28596203

SCHEMBL28596203

COC(=O)C1(Oc2ccc(C(=O)c3ccc(Cl)cc3)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.57
ELANE P08246 1/20 0.47
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
FABP2 P12104 1/20 0.46
SLC22A12 Q96S37 1/20 0.46
PTGS2 P35354 2/20 0.43
POLB P06746 1/20 0.43
VNN1 O95497 1/20 0.42
MAPK1 P28482 2/20 0.42
SRD5A2 P31213 1/20 0.42
LSS P48449 1/20 0.42
MAPT P10636 3/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ABCB11 O95342 1/20 0.41

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
SCHEMBL696193 0.92 HPGD (0.43) HPGDPPARAPTGS2MAPTSMN1; SMN2
SCHEMBL28586027 0.87 GRM5 (0.43) HPGDPOLBMAPTRAB9ALMNA
SCHEMBL28585572 0.87 ELANE (0.50) HPGDELANEMAPK1SRD5A2MAPT
SCHEMBL28588033 0.87 LMNA (0.48) HPGDMAPK1SRD5A2MAPTRAB9A
SCHEMBL28590421 0.86 SRD5A2 (0.48) HPGDMAPK1SRD5A2MAPTRAB9A
SCHEMBL28591750 0.85 LMNA (0.57) HPGDMAPK1SRD5A2LSSMAPT
SCHEMBL28590432 0.85 LMNA (0.42) HPGDMAPK1MAPTRAB9ALMNA
SCHEMBL28591569 0.85 LMNA (0.53) HPGDELANEPPARGPPARAFABP2
SCHEMBL28591389 0.85 KMT2A (0.50) HPGDELANEPPARGPPARAFABP2
SCHEMBL28594375 0.85 KMT2A (0.43) HPGDPPARGPPARAPOLBMAPT

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
CN-113121331-A Phenoxy aromatic acid compound with cyclopropyl and pharmaceutically acceptable salt thereof, and preparation method and application thereof 华创合成制药股份有限公司 2021-07-16 CN claimed