SCHEMBL11434202

SCHEMBL11434202

Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(O)ccc(S(=O)(=O)O)c3c2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 2/20 0.43
▸ KMT2A Q03164 5/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ P2RX1 P51575 1/20 0.43
▸ TNNI3 P19429 1/20 0.41
▸ TNNT2 P45379 1/20 0.41
▸ TNNC1 P63316 1/20 0.41
▸ HKDC1 Q2TB90 1/20 0.41
▸ STAT3 P40763 1/20 0.41
▸ MAPT P10636 4/20 0.40
▸ HTT P42858 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ PLAU P00749 2/20 0.40
▸ F2 P00734 1/20 0.40
▸ F10 P00742 1/20 0.40
▸ PLAT P00750 1/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.39
▸ LMNA P02545 2/20 0.39

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
SCHEMBL11421866 0.92 KCNMA1 (0.46) KCNMA1KMT2AMEN1RAB9AP2RX1
SCHEMBL11425192 0.88 KCNMA1 (0.44) KCNMA1KMT2AMEN1RAB9AMAPT
SCHEMBL11438365 0.87 TNF (0.45) KCNMA1KMT2AMEN1RAB9AMAPT
SCHEMBL11428140 0.85 PLAU (0.46) KMT2AMEN1RAB9AP2RX1TNNI3
SCHEMBL11432089 0.84 KCNMA1 (0.43) KCNMA1KMT2AMEN1RAB9AP2RX1
SCHEMBL11425750 0.84 KMT2A (0.42) KCNMA1KMT2AMEN1RAB9AMAPT
SCHEMBL11431542 0.84 NT5E (0.55) KCNMA1KMT2AMEN1RAB9AMAPT
SCHEMBL11430407 0.84 KCNMA1 (0.47) KCNMA1KMT2AMEN1STAT3MAPT
SCHEMBL11434200 0.83 MEN1 (0.56) KMT2AMEN1RAB9AMAPTPOLB
SCHEMBL11215156 0.83 NT5E (0.54) KCNMA1KMT2AMEN1RAB9AMAPT

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
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