SCHEMBL3432282

SCHEMBL3432282

O=C(O)Oc1cc(-c2cc(F)cc(Cl)c2)n(-c2cccc(Cl)c2)n1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.52
RXRB P28702 6/20 0.52
RXRG P48443 6/20 0.52
PPP1CA P62136 1/20 0.48
SLC16A3 O15427 2/20 0.42
SLC16A1 P53985 2/20 0.42
KMT2A Q03164 2/20 0.42
FABP3 P05413 1/20 0.41
FABP4 P15090 1/20 0.41
MEN1 O00255 1/20 0.40
ATM Q13315 1/20 0.40
SLC5A1 P13866 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MCTS1 Q9ULC4 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MARS1 P56192 1/20 0.39
CHRNA7 P36544 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL3428855 0.95 PPP1CA (0.50) RXRARXRBRXRGPPP1CASLC16A3
SCHEMBL3429676 0.91 PPP1CA (0.46) RXRARXRBRXRGPPP1CASLC16A3
SCHEMBL3428023 0.88 SLC16A3 (0.54) RXRARXRBRXRGPPP1CASLC16A3
SCHEMBL3434215 0.87 PGR (0.44) RXRARXRBRXRGPPP1CASLC16A3
SCHEMBL14995358 0.87 MARS1 (0.46) RXRARXRBRXRGPPP1CASLC16A3
SCHEMBL14995435 0.86 RXRA (0.46) RXRARXRBRXRGPPP1CAKMT2A
SCHEMBL14995646 0.86 RXRA (0.41) RXRARXRBRXRGPPP1CAKMT2A
SCHEMBL1110857 0.86 PPP1CA (0.57) RXRARXRBRXRGPPP1CASLC16A3
SCHEMBL3431428 0.85 RXRA (0.47) RXRARXRBRXRGPPP1CASLC16A3
SCHEMBL3431908 0.85 KMT2A (0.51) RXRARXRBRXRGPPP1CAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254885-A1 (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES AiCuris GmbH & Co. KG (DE) 2010-12-01 EP disclosed
WO-2009115213-A1 (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES AICURIS GMBH & CO. KG (DE) 2009-09-24 WO disclosed