SCHEMBL10422318

SCHEMBL10422318

O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)Nc2ccccc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC25A1 P53007 1/20 0.66
▸ CA12 O43570 1/20 0.61
▸ CA2 P00918 1/20 0.61
▸ CA9 Q16790 1/20 0.61
▸ MAPT P10636 4/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ POLB P06746 1/20 0.61
▸ TDP1 Q9NUW8 1/20 0.58
▸ MCL1 Q07820 2/20 0.56
▸ NHERF1 O14745 1/20 0.56
▸ CRHBP P24387 1/20 0.56
▸ CRHR2 Q13324 1/20 0.56
▸ MEN1 O00255 5/20 0.53
▸ KMT2A Q03164 5/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ LMNA P02545 2/20 0.53
▸ MAPK1 P28482 2/20 0.53
▸ FSCN1 Q16658 1/20 0.53
▸ TP53 P04637 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52

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
SCHEMBL95345 0.86 ALDH1A1 (0.56) SLC25A1CA12CA2CA9MAPT
SCHEMBL11407805 0.84 CA2 (0.63) SLC25A1CA12CA2CA9MAPT
SCHEMBL8820451 0.83 CA2 (0.61) SLC25A1CA12CA2CA9MAPT
SCHEMBL7572373 0.83 L3MBTL1 (0.67) CA12CA2CA9MAPTALDH1A1
SCHEMBL23832738 0.83 CA12 (0.61) SLC25A1CA12CA2CA9MAPT
SCHEMBL9635088 0.82 ALDH1A1 (0.53) SLC25A1CA2MAPTALDH1A1POLB
SCHEMBL9749290 0.82 CRHBP (0.61) SLC25A1CA12CA2CA9MAPT
SCHEMBL7443125 0.82 SLC25A1 (0.68) SLC25A1CA12CA2CA9MAPT
SCHEMBL7015594 0.81 GUSB (0.66) SLC25A1CA12CA2CA9MAPT
SCHEMBL2741009 0.81 CA2 (0.58) SLC25A1CA12CA2CA9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0356382-A2 Multilayer plaster CIBA-GEIGY AG (CH) 1990-02-28 — — EP claimed
EP-0255020-B1 WATER SOLUBLE TRIPHENODIOXAZINE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1990-09-19 — — EP disclosed
EP-0356382-A2 Multilayer plaster CIBA-GEIGY AG (CH) 1990-02-28 — — EP disclosed
US-4895954-A Dyeing wool, cellulose HOECHST AKTIENGESELLSCHAFT (DE) 1990-01-23 — — US disclosed
US-4816574-A FIBER-REACTIVE DYES FOR WOOL, CELLULOSE HOECHST AKTIENGESELLSCHAFT (DE) 1989-03-28 — — US disclosed
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