SCHEMBL10657289

SCHEMBL10657289

Cc1cc([N+](=O)[O-])c(Cl)cc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.71
▸ MAPT P10636 3/20 0.71
▸ CRHBP P24387 2/20 0.63
▸ CRHR2 Q13324 2/20 0.63
▸ SLC25A1 P53007 1/20 0.55
▸ GAA P10253 5/20 0.53
▸ LMNA P02545 3/20 0.53
▸ HTT P42858 3/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ HPGD P15428 2/20 0.53
▸ ALOX15 P16050 2/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ DNMT1 P26358 1/20 0.52
▸ DNMT3A Q9Y6K1 1/20 0.52
▸ VCAM1 P19320 1/20 0.50
▸ BRD4 O60885 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ FFAR4 Q5NUL3 1/20 0.49
▸ TSHR P16473 1/20 0.49

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
SCHEMBL10615498 0.88 CRHBP (0.67) ALDH1A1MAPTCRHBPCRHR2SLC25A1
SCHEMBL28711028 0.83 ALDH1A1 (0.70) ALDH1A1MAPTCRHBPCRHR2SLC25A1
SCHEMBL5956066 0.82 LMNA (0.57) ALDH1A1MAPTCRHBPCRHR2SLC25A1
SCHEMBL10658746 0.80 VCAM1 (0.44) ALDH1A1MAPTGAALMNAHTT
SCHEMBL11749307 0.79 SLC25A1 (0.68) ALDH1A1MAPTCRHBPCRHR2SLC25A1
SCHEMBL7588981 0.77 ALDH1A1 (0.64) ALDH1A1MAPTCRHBPCRHR2GAA
SCHEMBL10661530 0.77 CRHBP (0.71) ALDH1A1MAPTCRHBPCRHR2LMNA
SCHEMBL28701969 0.77 ALDH1A1 (0.64) ALDH1A1MAPTCRHBPCRHR2SLC25A1
SCHEMBL28821820 0.77 HPGD (0.70) ALDH1A1MAPTCRHBPCRHR2LMNA
SCHEMBL29507647 0.77 MAPT (0.69) ALDH1A1MAPTCRHBPCRHR2SLC25A1

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-0292911-A2 Process for the preparation of pure nitro-aminobenzene-compounds HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-30 — — EP disclosed
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