SCHEMBL11060870

SCHEMBL11060870

Cc1nc(Cl)ncc1N(S)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 3/20 0.38
JUN P05412 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
XPO1 O14980 1/20 0.35
LMNA P02545 1/20 0.31
ABL1 P00519 1/20 0.30
POLB P06746 1/20 0.30
ATF1 P18846 1/20 0.30

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
SCHEMBL30748863 0.75 NFKB1 (0.41) NFKB1JUNNFKB2RELAXPO1
SCHEMBL11058664 0.73
SCHEMBL3909479 0.70 JUN (0.54) NFKB1JUNNFKB2RELAXPO1
SCHEMBL11058688 0.69 POLB (0.35) LMNAPOLB
SCHEMBL12303887 0.68 SYK (0.40) NFKB1JUNNFKB2RELAXPO1
SCHEMBL17593300 0.67 NFKB1 (0.47) NFKB1JUNNFKB2RELAXPO1
SCHEMBL10959345 0.66 PLAU (0.41) ABL1POLB
SCHEMBL11061566 0.66 POLB (0.32) POLB
SCHEMBL11064906 0.65 MAP3K7 (0.32) LMNA
SCHEMBL15993551 0.65 SIRT6 (0.34)

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