SCHEMBL31474590

SCHEMBL31474590

O=C(O)CC(=O)OC(Cl)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
LMNA P02545 2/20 0.39
HPGD P15428 1/20 0.39
KLK7 P49862 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GABBR2 O75899 1/20 0.38
GABBR1 Q9UBS5 1/20 0.38
CYP2C19 P33261 1/20 0.38
TSHR P16473 3/20 0.38
CYP2D6 P10635 2/20 0.38
AKR1B1 P15121 1/20 0.38
SRC P12931 1/20 0.38
HTT P42858 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37

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
SCHEMBL27847316 0.85 ACE (0.44) KMT2ACRHBPCRHR2LMNAALDH1A1
SCHEMBL11217782 0.83 ALDH1A1 (0.45) KMT2ACRHBPCRHR2LMNAALDH1A1
SCHEMBL15066230 0.81 LMNA (0.41) KMT2ALMNAHPGDALDH1A1TSHR
SCHEMBL27821076 0.81 CRHBP (0.57) KMT2ACRHBPCRHR2LMNAHPGD
SCHEMBL27805540 0.80 TSHR (0.61) CRHBPCRHR2KLK7ALDH1A1TSHR
SCHEMBL7089128 0.80 CRHBP (0.36) KMT2ACRHBPCRHR2LMNAHPGD
SCHEMBL2295734 0.79 LMNA (0.42) KMT2ACRHBPCRHR2LMNAGABBR2
SCHEMBL984298 0.78 CYP2D6 (0.44) KMT2ALMNAHPGDALDH1A1TSHR
SCHEMBL1096587 0.78 CYP2D6 (0.44) KMT2ALMNAHPGDALDH1A1TSHR
SCHEMBL27840777 0.78 CYP2D6 (0.44) KMT2ALMNAHPGDALDH1A1TSHR

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-119698408-A Process for preparing substituted benzamides 安道麦马克西姆有限公司 2025-03-25 CN disclosed