SCHEMBL6302158

SCHEMBL6302158

O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1ccc2cc3ccc(NC(=O)Nc4ccc([N+](=O)[O-])cc4)cc3nc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.68
▸ KMT2A Q03164 9/20 0.68
▸ MAPT P10636 7/20 0.57
▸ NPC1 O15118 5/20 0.57
▸ RAB9A P51151 4/20 0.57
▸ MAPK1 P28482 3/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57
▸ MYOC Q99972 1/20 0.57
▸ BAZ1A Q9NRL2 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ APEX1 P27695 1/20 0.56
▸ POLB P06746 3/20 0.54
▸ TP53 P04637 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ GLA P06280 1/20 0.54
▸ TNNI3 P19429 1/20 0.54
▸ TNNT2 P45379 1/20 0.54
▸ TNNC1 P63316 1/20 0.54
▸ RUNX1 Q01196 1/20 0.54

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
SCHEMBL6295866 0.87 ALDH1A1 (0.57) MEN1KMT2AMAPTNPC1NPSR1
SCHEMBL1177730 0.82 MEN1 (1.00) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL6302157 0.82 MEN1 (1.00) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL5657895 0.80 NPC1 (0.74) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL9613320 0.78 MEN1 (0.56) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL6302417 0.77 MEN1 (0.89) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL3460442 0.76 MEN1 (0.79) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL11055960 0.76 MEN1 (0.85) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL27968750 0.76 MEN1 (0.72) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL8371944 0.75 MEN1 (0.66) MEN1KMT2AMAPTNPC1RAB9A

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-6875764-B1 Urea and thiourea compounds useful for treatment of coccidiosis NEW PHARMA RESEARCH SWEDEN AB (SE) 2005-04-05 — — US disclosed
EP-1224165-A1 NOVEL COMPOUNDS New Pharma Research Sweden AB (SE) 2002-07-24 — — EP disclosed
WO-2001030749-A1 NOVEL COMPOUNDS NEW PHARMA RESEARCH SWEDEN AB (SE) 2001-05-03 — — WO disclosed
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