SCHEMBL7040461

SCHEMBL7040461

CCCCN(CCCC)CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
ALDH1A1 P00352 3/20 0.56
MAPT P10636 3/20 0.56
GAA P10253 1/20 0.56
USP2 O75604 1/20 0.53
CA2 P00918 3/20 0.53
CA1 P00915 2/20 0.53
CA12 O43570 2/20 0.53
CA9 Q16790 2/20 0.53
CA3 P07451 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA13 Q8N1Q1 1/20 0.53
CA14 Q9ULX7 1/20 0.53
CA5B Q9Y2D0 1/20 0.53
RAB9A P51151 1/20 0.52
ALOX15 P16050 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
SCHEMBL7042308 0.95 MEN1 (0.56) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL7038862 0.95 MEN1 (0.53) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL7042796 0.90 USP2 (0.65) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL4091384 0.89 ALDH1A1 (0.64) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL7042471 0.86 SIGMAR1 (0.55) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL10571075 0.86 ALDH1A1 (0.61) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL1667635 0.85 CA2 (0.68) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL3685056 0.82 MEN1 (0.62) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL1674065 0.82 SIGMAR1 (0.68) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL3387197 0.82 USP2 (0.57) MEN1KMT2AALDH1A1USP2CA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1052248-B1 Process for the preparation of aqueous solutions of diazonium salts CLARIANT GMBH (DE) 2003-03-19 EP disclosed
US-6207809-B1 CATALYTIC HYDROGENATION USING THE CORRESPONDING NITRO COMPOUND CLARIANT GMBH (DE) 2001-03-27 US disclosed
EP-1052248-A1 Process for the preparation of aqueous solutions of diazonium salts Clariant GmbH (DE) 2000-11-15 EP disclosed