SCHEMBL29132827

SCHEMBL29132827

O=Cc1ccc2c(c1Cl)C(=O)OC2=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
TYMS P04818 2/20 0.37
TDP1 Q9NUW8 3/20 0.37
ALOX15 P16050 1/20 0.37
KCNJ1 P48048 1/20 0.37
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
PTPN1 P18031 1/20 0.33
ERN1 O75460 1/20 0.31

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
SCHEMBL29462450 0.76 TYMS (0.50) ALDH1A1TSHRTYMSTDP1ALOX15
SCHEMBL855450 0.76 TYMS (0.50) ALDH1A1TSHRTYMSTDP1ALOX15
SCHEMBL10432889 0.75 TDP1 (0.46) ALDH1A1TSHRTYMSTDP1ALOX15
SCHEMBL8764869 0.74 ALDH1A1 (0.47) ALDH1A1TSHRTYMSTDP1ALOX15
SCHEMBL8849279 0.73 ALDH1A1 (0.43) ALDH1A1TSHRTYMSTDP1ALOX15
Fluoride Ion SCHEMBL11260088 0.73 TYMS (0.47) ALDH1A1TSHRTYMSTDP1ALOX15
SCHEMBL9771012 0.73 ALDH1A1 (0.43) ALDH1A1TSHRTYMSTDP1ALOX15
SCHEMBL855172 0.73 ALDH1A1 (0.43) ALDH1A1TSHRTYMSTDP1ALOX15
SCHEMBL6541546 0.73 TYMS (0.51) ALDH1A1TSHRTYMSMEN1LMNA
SCHEMBL4939317 0.72 ALDH1A1 (0.46) ALDH1A1TSHRTDP1MEN1LMNA

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-115826360-A Photosensitive polyimide composition, method for producing pattern, cured product, and electronic component 江苏艾森半导体材料股份有限公司 2023-03-21 CN disclosed