SCHEMBL11433700

SCHEMBL11433700

Cc1ccc(C(=O)Nc2ccc3c(O)c(S(=O)(=O)O)ccc3c2)cc1[N+](=O)[O-]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.55
▸ LMNA P02545 5/20 0.55
▸ RAB9A P51151 5/20 0.55
▸ NPC1 O15118 4/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ ATM Q13315 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ MEN1 O00255 10/20 0.51
▸ KMT2A Q03164 10/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ POLB P06746 1/20 0.51
▸ CTDSP1 Q9GZU7 1/20 0.51
▸ GAA P10253 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL11438362 0.92 MAPT (0.55) MAPTLMNARAB9ANPC1MAPK1
SCHEMBL11421862 0.87 MAPT (0.56) MAPTLMNARAB9ANPC1MAPK1
SCHEMBL11432108 0.86 MAPT (0.55) MAPTLMNARAB9ANPC1MAPK1
SCHEMBL11426296 0.86 MAPT (0.55) MAPTLMNARAB9ANPC1MAPK1
SCHEMBL11428748 0.85 NT5E (0.55) MAPTLMNARAB9ANPC1MAPK1
SCHEMBL11422942 0.84 CD40 (0.57) MAPTLMNARAB9ANPC1MAPK1
SCHEMBL11422986 0.84 MEN1 (0.56) MAPTLMNARAB9ANPC1MEN1
SCHEMBL11436275 0.84 CTDSP1 (0.62) MAPTLMNARAB9ANPC1MAPK1
SCHEMBL11427835 0.83 CASP6 (0.49) MAPTRAB9ANPC1TDP1MEN1
SCHEMBL11423101 0.83 ALDH1A1 (0.60) MAPTLMNARAB9ANPC1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4216166-A Nitro precursors to amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 — — US disclosed
Send feedback