SCHEMBL7569486

SCHEMBL7569486

CC1(C)C(=O)N(c2cc(Cl)cc(Cl)c2)C(=O)N1CC#CI

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.44
TSHR P16473 1/20 0.42
ITGAL P20701 3/20 0.39
ITGB2 P05107 2/20 0.39
ICAM1 P05362 2/20 0.39
IGF1R P08069 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
SCHEMBL8445574 0.72 RAB9A (0.35)
SCHEMBL8445410 0.69 ENPP2 (0.37) TSHR
SCHEMBL12603210 0.67 ITGB2 (0.46) ARITGALITGB2ICAM1IGF1R
SCHEMBL8445120 0.66 RAB9A (0.36)
SCHEMBL8010634 0.65 TAS2R8 (0.44) ARITGALITGB2ICAM1IGF1R
SCHEMBL8441783 0.64 PTGS1 (0.38)
SCHEMBL8442425 0.63 ELANE (0.45)
SCHEMBL11170138 0.62 AR (0.56) ARTSHRITGAL
Procymidone SCHEMBL23093 0.60 TSHR (1.00) TSHRITGALITGB2ICAM1
SCHEMBL11257965 0.59 TSHR (0.46) TSHRITGALITGB2ICAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946093-B1 FUNGICIDAL COMPOSITIONS BASED ON (N-PHENYLACETYL-N-2,6-XYLYL)METHYL ALANINATE ISAGRO SPA (IT) 2002-08-28 EP claimed
EP-0572191-B1 N-iodopropargyl hydantoin compounds, compositions, preparation, and use as antimicrobial agents ROHM & HAAS (US) 1996-09-04 EP claimed
EP-0572191-A1 N-iodopropargyl hydantoin compounds, compositions, preparation, and use as antimicrobial agents ROHM AND HAAS COMPANY (US) 1993-12-01 EP claimed
US-6008244-A APPLYING ONTO OR INTO THE MARINE STRUCTURE TO INHIBIT GROWTH SUCH AS SOFT CORALS, TUNICATES, HYDROIDS, SPONGES, ANEMONES, BARNACLES, TUBEWORMS AND MOLLUSCS ROHM AND HAAS COMPANY (US) 1999-12-28 US disclosed
CN-1180477-A Halopropargyl compounds as marine antifouling agents ROHM & HAAS (US) 1998-05-06 CN disclosed
EP-0835604-A1 Halopropargyl compounds as marine antifouling agents ROHM AND HAAS COMPANY (US) 1998-04-15 EP disclosed
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