SCHEMBL10812182

SCHEMBL10812182

CSc1nnc(-c2ccc(Cl)cc2)c(C)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.54
▸ KMT2A Q03164 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ ADORA2A P29274 1/20 0.45
▸ ADORA1 P30542 1/20 0.45
▸ TDP1 Q9NUW8 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ AHR P35869 1/20 0.40
▸ CTDSP1 Q9GZU7 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
SCHEMBL10812119 0.89 NPSR1 (0.68) NPSR1KMT2AMAPTGAAMEN1
SCHEMBL14665605 0.83 NPSR1 (0.46) NPSR1KMT2AMAPTGAAMEN1
SCHEMBL10809881 0.83 NPSR1 (0.54) NPSR1KMT2AMAPTGAAMEN1
SCHEMBL10808538 0.82 NPSR1 (0.79) NPSR1KMT2AMAPTMEN1ADORA2A
SCHEMBL10810550 0.81 NPSR1 (0.53) NPSR1KMT2AMEN1ADORA2AADORA1
SCHEMBL10808164 0.80 NPSR1 (0.51) NPSR1KMT2AMAPTMEN1TDP1
SCHEMBL10812615 0.77 NPSR1 (0.70) NPSR1KMT2AMAPTGAAMEN1
SCHEMBL10846356 0.76 TNFSF10 (0.48) NPSR1KMT2AMAPTMEN1L3MBTL1
SCHEMBL10815512 0.73 NPSR1 (0.51) NPSR1KMT2AMAPTGAAMEN1
SCHEMBL10847185 0.73 NPSR1 (0.56) NPSR1KMT2AMAPTMEN1ADORA2A

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
EP-0077983-B1 TRIAZINE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-04-29 — — EP disclosed
US-4616014-A HYPOTENSIVE AGENTS, ANTICOAGULANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-07 — — US disclosed
EP-0077983-A1 Triazine derivatives, processes for preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-05-04 — — EP disclosed
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