SCHEMBL11515000

SCHEMBL11515000

Cc1ccc(C(=O)Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)c(NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ MAPK1 P28482 3/20 0.45
▸ LMNA P02545 3/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ IDH1 O75874 4/20 0.44
▸ TDP1 Q9NUW8 3/20 0.41
▸ HPSE Q9Y251 2/20 0.41
▸ RECQL P46063 2/20 0.41
▸ TIMP3 P35625 2/20 0.41
▸ ENPP3 O14638 1/20 0.41
▸ ENTPD3 O75355 1/20 0.41
▸ NR1I2 O75469 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ PRKD3 O94806 1/20 0.41
▸ TDP2 O95551 1/20 0.41
▸ CBX7 O95931 1/20 0.41

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
SCHEMBL11513848 0.90 MAPT (0.53) MAPTMEN1KMT2AMAPK1LMNA
SCHEMBL11513840 0.90 MAPT (0.53) MAPTMEN1KMT2AMAPK1LMNA
SCHEMBL11515015 0.89 KCNMA1 (0.48) MAPTMEN1KMT2AMAPK1LMNA
SCHEMBL11514991 0.86 MAPT (0.56) MAPTMEN1KMT2AMAPK1LMNA
SCHEMBL11593391 0.86 TIMP3 (0.53) MAPTMEN1KMT2AMAPK1LMNA
SCHEMBL11512686 0.85 KMT2A (0.59) MAPTMEN1KMT2AMAPK1LMNA
SCHEMBL11512365 0.84 KCNMA1 (0.46) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL11514490 0.82 KCNMA1 (0.43) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL11512944 0.82 TIMP3 (0.52) MAPTMEN1KMT2AIDH1TDP1
SCHEMBL11513850 0.81 ALDH1A1 (0.46) MAPTKMT2AMAPK1LMNASMN1; SMN2

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
US-4147801-A UREYLENEBIS/METHYL-PHENYLENE/UREYLENE//DI-1,3,6-NAPHTHALENE TRISULFONIC ACID AMERICAN CYANAMID COMPANY (US) 1979-04-03 — — US disclosed
US-4146640-A SULFONIC ACID AND SECONDARY AMIDE FUNCTIONAL GROUPS AMERICAN CYANAMID COMPANY (US) 1979-03-27 — — US disclosed
US-4087548-A NAPHTHALENE TRISULFONIC ACIDS AMERICAN CYANAMID COMPANY (US) 1978-05-02 — — US disclosed
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