SCHEMBL11265077

SCHEMBL11265077

c1ccc(CSNc2nc(Nc3ccccc3)nc(Nc3ccccc3)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 11/20 0.57
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
GAA P10253 2/20 0.50
MAPK1 P28482 1/20 0.50
KDM4E B2RXH2 1/20 0.50
RECQL P46063 1/20 0.47
MCL1 Q07820 1/20 0.47
NFKB1 P19838 1/20 0.46
METAP2 P50579 1/20 0.44
METAP1 P53582 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 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
SCHEMBL11155028 0.81 MAPT (0.47) KCNH3MEN1MAPTKMT2AMAPK1
SCHEMBL11252354 0.78 APP (0.47) KCNH3MEN1KMT2AGAAMAPK1
SCHEMBL3431056 0.77 IDO1 (0.40) METAP2METAP1LMNA
SCHEMBL11254673 0.77 NPSR1 (0.46) MEN1MAPTKMT2ANPSR1LMNA
SCHEMBL633400 0.77 MEN1 (0.77) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL11256328 0.73 ALDH1A1 (0.51) MEN1MAPTKMT2AMAPK1NPSR1
SCHEMBL11257385 0.73 MEN1 (0.55) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL18123046 0.72 MEN1 (0.71) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL11263145 0.72 CTSS (0.51) GAAKDM4ELMNA
SCHEMBL8506448 0.71 MEN1 (0.63) KCNH3MEN1MAPTKMT2AGAA

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-4339577-A CROSSLINKING INHIBITORS FOR RUBBERS MONSANTO COMPANY (US) 1982-07-13 US disclosed
US-4301260-A Vulcanizable rubber compositions scorch inhibited by 2-(thioamino)-4,6-diamino-1,3,5-triazines MONSANTO COMPANY (US) 1981-11-17 US disclosed