SCHEMBL10882284

SCHEMBL10882284

Nc1cc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)O)ccc1Cl

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 2/20 0.65
▸ MEN1 O00255 7/20 0.50
▸ KMT2A Q03164 7/20 0.50
▸ MAPT P10636 6/20 0.50
▸ GAA P10253 4/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ TDP1 Q9NUW8 3/20 0.50
▸ GFER P55789 2/20 0.50
▸ ATM Q13315 1/20 0.50
▸ RAPGEF4 Q8WZA2 1/20 0.48
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ MAPK1 P28482 1/20 0.45
▸ BCL6 P41182 1/20 0.45
▸ BCOR Q6W2J9 1/20 0.45
▸ TBXA2R P21731 5/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ POLB P06746 2/20 0.44

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
SCHEMBL10708423 0.92 NT5E (0.66) NT5EMEN1KMT2AMAPTGAA
SCHEMBL10762587 0.89 NT5E (0.50) NT5EMEN1KMT2AMAPTGAA
SCHEMBL11110261 0.89 NT5E (0.69) NT5EMEN1KMT2AMAPTGAA
SCHEMBL11104382 0.88 NT5E (0.70) NT5EMEN1KMT2AMAPTGAA
SCHEMBL10702427 0.87 NT5E (0.71) NT5EMEN1KMT2AMAPTGAA
SCHEMBL10880062 0.86 NT5E (0.65) NT5EMEN1KMT2AMAPTGAA
SCHEMBL10881471 0.84 NT5E (0.66) NT5EMEN1KMT2AMAPTGAA
SCHEMBL2032113 0.84 NT5E (0.85) NT5EMEN1KMT2AMAPTGAA
SCHEMBL10707915 0.83 NT5E (0.61) NT5EMEN1KMT2AMAPTGAA
SCHEMBL10706902 0.81 NT5E (0.62) NT5EMEN1KMT2AMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0126378-B1 PREPARATION PROCESS OF ACID NITRO DYES HOECHST AKTIENGESELLSCHAFT (DE) 1986-07-09 — — EP claimed
US-4599450-A Process for the preparation of acid nitro dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1986-07-08 — — US claimed
EP-0126378-A1 Preparation process of acid nitro dyes HOECHST AKTIENGESELLSCHAFT (DE) 1984-11-28 — — EP claimed
US-4599450-A Process for the preparation of acid nitro dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1986-07-08 — — US disclosed
US-4591359-A Process for preparing acid nitro dyestuffs for leather HOECHST AKTIENGESELLSCHAFT (DE) 1986-05-27 — — US disclosed
EP-0137243-A2 Process for the manufacture of acid nitro dyes HOECHST AKTIENGESELLSCHAFT (DE) 1985-04-17 — — EP disclosed
EP-0126378-A1 Preparation process of acid nitro dyes HOECHST AKTIENGESELLSCHAFT (DE) 1984-11-28 — — EP disclosed
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