SCHEMBL9842953

SCHEMBL9842953

CCCC(=O)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.67
ALDH1A1 P00352 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
HPGD P15428 2/20 0.57
LMNA P02545 1/20 0.57
TP53 P04637 1/20 0.56
ACP1 P24666 1/20 0.54
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
FABP4 P15090 1/20 0.53
F2R P25116 3/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.49
GSK3B P49841 1/20 0.48

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
SCHEMBL9544710 0.90 L3MBTL1 (0.55) L3MBTL1ALDH1A1MEN1KMT2AHPGD
SCHEMBL8614195 0.86 L3MBTL1 (0.59) L3MBTL1LMNAPOLB
SCHEMBL30764851 0.86 L3MBTL1 (0.59) L3MBTL1LMNAPOLB
SCHEMBL14670859 0.84 L3MBTL1 (0.61) L3MBTL1ALDH1A1MEN1KMT2AACP1
SCHEMBL8278749 0.82 F2R (0.65) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL14035376 0.81 ALDH1A1 (0.62) L3MBTL1ALDH1A1MEN1KMT2AHPGD
SCHEMBL1531710 0.81 ALOX5 (0.59) L3MBTL1ALDH1A1MEN1KMT2AHPGD
SCHEMBL8415139 0.81 MEN1 (0.62) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL8278746 0.81 TP53 (0.72) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL1324419 0.79 L3MBTL1 (0.65) L3MBTL1ALDH1A1MEN1KMT2AACP1

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
EP-0440503-A1 4-Isoxazolecarboxamide derivatives SYNTEX (U.S.A.) INC. (US) 1991-08-07 EP disclosed