SCHEMBL9835501

SCHEMBL9835501

CCCC(=O)c1cc2c(c(OC)c1)CC(=O)N2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 5/20 0.42
▸ PDE4A P27815 4/20 0.42
▸ PDE4B Q07343 4/20 0.42
▸ PDE4C Q08493 4/20 0.42
▸ CCNB2 O95067 5/20 0.40
▸ CDK1 P06493 5/20 0.40
▸ CCNB1 P14635 5/20 0.40
▸ CCNB3 Q8WWL7 5/20 0.40
▸ GSK3B P49841 3/20 0.40
▸ CDK5 Q00535 2/20 0.40
▸ CDK5R1 Q15078 2/20 0.40
▸ FASN P49327 1/20 0.38
▸ MDH2 P40926 4/20 0.38
▸ THRA P10827 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ CTNNB1 P35222 1/20 0.37
▸ WNT3A P56704 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ TUBB4A P04350 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
SCHEMBL9836107 0.77 CYP1A2 (0.45) CCNB2CDK1CCNB1CCNB3GSK3B
SCHEMBL7837299 0.73 ALDH1A1 (0.61) PDE4DPDE4APDE4BPDE4CFASN
SCHEMBL624796 0.73 PKM (0.58) PDE4DPDE4APDE4BPDE4CFASN
SCHEMBL10626074 0.71 CRBN (0.55) ALDH1A1MAPT
SCHEMBL22491426 0.70 CA12 (0.47) ALDH1A1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL22491481 0.69 CRBN (0.48) CCNB2CDK1CCNB1CCNB3GSK3B
SCHEMBL29734435 0.69 CRBN (0.48) CCNB2CDK1CCNB1CCNB3GSK3B
SCHEMBL3389331 0.69 EPHX2 (0.61) —
SCHEMBL6600362 0.68 CTNNB1 (0.71) PDE4DPDE4APDE4BPDE4CTHRA
SCHEMBL30313764 0.68 CTNNB1 (0.71) PDE4DPDE4APDE4BPDE4CTHRA

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-0208510-B1 1-SUBSTITUTED OXINDOLE-3-CARBOXAMINES AS ANTIINFLAMMATORY AND ANALGESIC AGENTS PFIZER INC. (US) 1991-09-11 — — EP disclosed
US-4791129-A RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS PFIZER INC. (US) 1988-12-13 — — US disclosed
US-4725616-A ANTIARTHRITIC AGENTS PFIZER INC. (US) 1988-02-16 — — US disclosed
EP-0208510-A2 1-Substituted oxindole-3-carboxamines as antiinflammatory and analgesic agents PFIZER INC. (US) 1987-01-14 — — EP disclosed
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