SCHEMBL11060673

SCHEMBL11060673

CCCCOc1ncncc1NC(N)=S

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.35
CDC7 O00311 1/20 0.35
PLK4 O00444 1/20 0.35
CHEK1 O14757 1/20 0.35
CHUK O15111 1/20 0.35
PDPK1 O15530 1/20 0.35
DYRK3 O43781 1/20 0.35
ROCK2 O75116 1/20 0.35
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
PAK4 O96013 1/20 0.35
NTRK1 P04629 1/20 0.35
PRKCG P05129 1/20 0.35
INSR P06213 1/20 0.35
LCK P06239 1/20 0.35
FYN P06241 1/20 0.35
CDK1 P06493 1/20 0.35
FES P07332 1/20 0.35
CSF1R P07333 1/20 0.35
LYN P07948 1/20 0.35

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
SCHEMBL11057358 0.93 MAP3K7 (0.36) PRKD3MAP4K4GSK3AGSK3BMAP4K2
SCHEMBL11058186 0.87 ALDH1A1 (0.33) GSK3AGSK3BALDH1A1
SCHEMBL11058666 0.80 ATR (0.37) KMT2A
SCHEMBL11062437 0.79 ALDH1A1 (0.35) ALDH1A1
SCHEMBL11061052 0.79 MAPK1 (0.41) MAPK1CDC7PLK4CHEK1CHUK
SCHEMBL11058623 0.77 ATR (0.40) GSK3BIRAK4KMT2AALDH1A1
SCHEMBL11055924 0.74 MAPK1 (0.38) MAPK1CDC7PLK4CHEK1CHUK
SCHEMBL11060944 0.74 L3MBTL1 (0.35)
SCHEMBL11058678 0.74 LMNA (0.39) MAPK1CDC7PLK4CHEK1CHUK
SCHEMBL11060716 0.73 MEN1 (0.36) CDK1CDK2XDHMEN1PABPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4434167-A Pyrimidyl thioureas useful for the treatment of hypertension and hyperlipidemia BEIERSDORF AKTIENGESELLSCHAFT (DE) 1984-02-28 US disclosed