SCHEMBL11768353

SCHEMBL11768353

CCCNC(=O)Nc1ccc(Sc2c(Cl)cc([N+](=O)[O-])cc2Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.53
▸ KMT2A Q03164 8/20 0.53
▸ EPHX2 P34913 1/20 0.45
▸ MAPT P10636 10/20 0.45
▸ LMNA P02545 5/20 0.45
▸ ALDH1A1 P00352 5/20 0.45
▸ CNR1 P21554 1/20 0.44
▸ HTT P42858 4/20 0.44
▸ POLB P06746 1/20 0.44
▸ MAPK1 P28482 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ XBP1 P17861 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ CCR6 P51684 1/20 0.40
▸ PAX8 Q06710 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ THRB P10828 1/20 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
SCHEMBL11773712 0.94 LMNA (0.48) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL11770775 0.87 KMT2A (0.53) MEN1KMT2AEPHX2MAPTLMNA
SCHEMBL11768339 0.85 MAPT (0.48) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL11768957 0.85 LMNA (0.49) MAPTLMNAALDH1A1POLB
SCHEMBL11773871 0.83 KMT2A (0.50) MEN1KMT2AEPHX2MAPTLMNA
SCHEMBL11767194 0.82 MEN1 (0.56) MEN1KMT2AEPHX2MAPTLMNA
SCHEMBL11769994 0.81 KMT2A (0.47) MEN1KMT2AEPHX2MAPTLMNA
SCHEMBL11769287 0.79 LMNA (0.51) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL11770162 0.78 MAPT (0.50) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL11769597 0.78 LMNA (0.46) MEN1KMT2AMAPTLMNAALDH1A1

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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