SCHEMBL11770558

SCHEMBL11770558

CC(C)NC(=O)Nc1cc(Cl)c(Sc2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.48
▸ MAPT P10636 3/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ PDE7A Q13946 8/20 0.46
▸ PDE4B Q07343 1/20 0.44
▸ PDE4D Q08499 1/20 0.44
▸ PDE7B Q9NP56 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44

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
SCHEMBL11769287 0.87 LMNA (0.51) LMNAMAPTALDH1A1PDE7APDE4B
SCHEMBL11772426 0.86 KMT2A (0.46) LMNAMAPTALDH1A1POLBGAA
SCHEMBL11768957 0.84 LMNA (0.49) LMNAMAPTALDH1A1PDE7APDE4B
SCHEMBL11773712 0.83 LMNA (0.48) LMNAMAPTALDH1A1PDE7APDE4B
SCHEMBL11768339 0.81 MAPT (0.48) LMNAMAPTALDH1A1PDE7APDE4B
SCHEMBL11769597 0.80 LMNA (0.46) LMNAMAPTALDH1A1PDE7APDE4B
SCHEMBL11839070 0.78 KMT2A (0.57) LMNAMAPTALDH1A1PDE7APOLB
SCHEMBL21750971 0.77 MAPK1 (0.62) LMNAMAPTALDH1A1POLBGAA
SCHEMBL11768353 0.76 MEN1 (0.53) LMNAMAPTALDH1A1POLBGAA
SCHEMBL7605606 0.75 LMNA (0.73) LMNAMAPTALDH1A1PDE7APDE4B

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-3970752-A Coccidiocidal compositions utilizing 1-phenyl-substituted 1,3,5-triazine BAYER AKTIENGESELLSCHAFT (DT) 1976-07-20 — — US disclosed
US-3948893-A COCCIDIOSIS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-06 — — US disclosed
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