SCHEMBL29095265

SCHEMBL29095265

Cc1ccc(S(=O)(=O)NCC(c2ccccc2)c2ccc3c(c2)OCO3)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ LMNA P02545 5/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ MAPT P10636 4/20 0.47
▸ TP53 P04637 3/20 0.47
▸ THRB P10828 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ ATM Q13315 1/20 0.47

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
SCHEMBL28493442 0.84 KMT2A (0.49) HPGDSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL29554998 0.79 TP53 (0.55) HPGDSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL14417874 0.76 EDNRA (0.49) SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL29555017 0.76 MAPT (0.52) SMN1; SMN2MEN1KMT2ALMNANPSR1
SCHEMBL29554724 0.75 LMNA (0.44) SMN1; SMN2MEN1KMT2ALMNANPSR1
SCHEMBL2846313 0.75 ADRB3 (0.47) HPGDSMN1; SMN2MEN1KMT2AMAPT
SCHEMBL19392334 0.74 KMT2A (0.75) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL29555080 0.73 TP53 (0.52) SMN1; SMN2MEN1KMT2ALMNANPSR1
SCHEMBL28498338 0.72 ALDH1A1 (0.65) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL9968019 0.72 LMNA (0.84) HPGDSMN1; SMN2MEN1KMT2ALMNA

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-114315660-B Method for preparing 2-arylphenethylamine derivative 江苏海洋大学 2023-09-22 — — CN disclosed
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