SCHEMBL8997583

SCHEMBL8997583

C#CCN1C(=O)N(c2cc(Cl)cc(Cl)c2)C(=O)C1C

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMO Q99835 5/20 0.47
VRK1 Q99986 3/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL7572015 0.83 SMO (0.45) SMOTSHR
SCHEMBL10930161 0.80 SMO (0.50) SMOTSHR
SCHEMBL10667708 0.77 SMO (0.47) SMOTSHR
SCHEMBL10671485 0.72 SMO (0.35) SMOTSHR
SCHEMBL7572209 0.70 SMO (0.60) SMO
SCHEMBL11463560 0.67 VRK1 (0.37) VRK1
SCHEMBL11762036 0.66 TSHR (0.47) TSHR
SCHEMBL13688333 0.64 ITGB2 (0.41) SMOTSHR
SCHEMBL22898690 0.63 TSHR (0.44) TSHR
SCHEMBL19707552 0.62 SMO (0.61) SMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0572191-B1 N-iodopropargyl hydantoin compounds, compositions, preparation, and use as antimicrobial agents ROHM & HAAS (US) 1996-09-04 EP disclosed
US-5346913-A Agricultural fungicides ROHM AND HAAS COMPANY (US) 1994-09-13 US disclosed
EP-0572191-A1 N-iodopropargyl hydantoin compounds, compositions, preparation, and use as antimicrobial agents ROHM AND HAAS COMPANY (US) 1993-12-01 EP disclosed
US-4753957-A Substituted 2,4-imidazolidinediones and fungicidal compositions ROHM AND HAAS COMPANY (US) 1988-06-28 US disclosed