SCHEMBL30114756

SCHEMBL30114756

O=C(c1ccccc1)c1ccccc1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.85
AKR1C3 P42330 3/20 0.65
CES2 O00748 1/20 0.65
CES1 P23141 1/20 0.65
ALDH1A1 P00352 2/20 0.63
CYP1A2 P05177 1/20 0.63
CYP3A4 P08684 1/20 0.63
CYP2C9 P11712 1/20 0.63
CYP2C19 P33261 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
SRD5A2 P31213 2/20 0.59
CDC25B P30305 2/20 0.57
ATM Q13315 1/20 0.57
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
ALOX15 P16050 1/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
LMNA P02545 1/20 0.52

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
SCHEMBL28451754 1.00 NR4A1 (0.85) NR4A1AKR1C3CES2CES1ALDH1A1
SCHEMBL3444656 0.96 NR4A1 (0.84) NR4A1AKR1C3CES2CES1ALDH1A1
SCHEMBL1247787 0.92 NR4A1 (1.00) NR4A1AKR1C3CES2CES1ALDH1A1
SCHEMBL30884880 0.92 NR4A1 (1.00) NR4A1AKR1C3CES2CES1ALDH1A1
SCHEMBL50462 0.89 SRD5A2 (0.74) NR4A1CES2CES1ALDH1A1L3MBTL1
SCHEMBL9442387 0.89 SRD5A2 (0.74) NR4A1CES2CES1ALDH1A1L3MBTL1
SCHEMBL6299251 0.88 NR4A1 (0.72) NR4A1AKR1C3CES2CES1ALDH1A1
SCHEMBL25233188 0.87 NR4A1 (0.66) NR4A1AKR1C3CES2CES1ALDH1A1
Hydrochloric Acid SCHEMBL4594202 0.86 SRD5A2 (0.71) NR4A1CES2CES1ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL4594201 0.86 SRD5A2 (0.71) NR4A1CES2CES1ALDH1A1L3MBTL1

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-114055791-B Method for bonding middle frame of mobile terminal and piece to be bonded 韦尔通(厦门)科技股份有限公司 2022-10-04 CN disclosed