SCHEMBL9820416

SCHEMBL9820416

O=C(Nc1ccc(/C=C/c2ccc([N+](=O)[O-])cc2S(=O)(=O)O)c(S(=O)(=O)O)c1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.57
▸ KMT2A Q03164 7/20 0.57
▸ NPC1 O15118 4/20 0.57
▸ RAB9A P51151 4/20 0.57
▸ POLB P06746 2/20 0.57
▸ MITF O75030 1/20 0.57
▸ CD40 P25942 2/20 0.51
▸ CD40LG P29965 2/20 0.51
▸ GPR17 Q13304 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.50
▸ MAPT P10636 4/20 0.50
▸ SNCA P37840 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ ENPP2 Q13822 1/20 0.49
▸ BLM P54132 1/20 0.49
▸ RAD51 Q06609 1/20 0.47
▸ ALOX5 P09917 1/20 0.47

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
SCHEMBL9820417 1.00 MEN1 (0.57) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL22003338 0.93 MEN1 (0.56) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL29366447 0.88 ENPP2 (0.60) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5694390 0.88 ENPP2 (0.60) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5694392 0.88 ENPP2 (0.60) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL22003616 0.86 RAD51 (0.67) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL8899690 0.86 ENPP2 (0.51) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL26725600 0.86 CD40 (0.53) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL15786964 0.83 NPC1 (0.57) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL700458 0.81 ENPP2 (0.53) MEN1KMT2ANPC1RAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5007942-A Light-polarizing films or sheets containing stilbene dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1991-04-16 — — US disclosed
EP-0374655-A1 Light-polarising films or foils containing stilbene pigments BAYER AG (DE) 1990-06-27 — — EP disclosed
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