SCHEMBL8440701

SCHEMBL8440701

CC1(C)NC(=O)N(CC#CI)C1=O

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
KMT2A Q03164 4/20 0.49
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
MEN1 O00255 3/20 0.41
TSHR P16473 2/20 0.41
LMNA P02545 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PADI4 Q9UM07 1/20 0.40
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 3/20 0.38
PLA2G7 Q13093 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
FPR2 P25090 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL8997602 0.77 POLB (0.61) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL19404136 0.74 POLB (0.68) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL11677768 0.73 POLB (0.74) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL11378894 0.73 POLB (1.00) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL8445574 0.73 RAB9A (0.35)
SCHEMBL5584023 0.71 POLB (0.71) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL13241881 0.71 POLB (0.63) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL11694927 0.70 POLB (0.68) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL2713635 0.70 POLB (0.68) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL11847614 0.70 POLB (0.68) POLBKMT2APDE4APDE4BPDE4C

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 11 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 claimed
US-5371233-A 2-(tetrazol-5-yl)-1,1'-biphenyl derivatives, their preparation and their use as synthetic intermediates SYNTHELABO (FR) 1994-12-06 US claimed
US-5346913-A Agricultural fungicides ROHM AND HAAS COMPANY (US) 1994-09-13 US 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-5371233-A 2-(tetrazol-5-yl)-1,1'-biphenyl derivatives, their preparation and their use as synthetic intermediates SYNTHELABO (FR) 1994-12-06 US 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