SCHEMBL9835372

SCHEMBL9835372

CC(=O)c1ccc2c(c1C)CC(=O)N2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.40
DHPS P49366 1/20 0.37
SRC P12931 1/20 0.35
GRIA1 P42261 2/20 0.35
CACNG8 Q8WXS5 2/20 0.35
DRD2 P14416 3/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
CHRM2 P08172 1/20 0.35
CYP3A4 P08684 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
ADRA2B P18089 1/20 0.35
DRD1 P21728 1/20 0.35
DRD4 P21917 1/20 0.35
DRD5 P21918 1/20 0.35
HTR2A P28223 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL5364713 0.87 P2RX7 (0.40) P2RX7DHPSSRCGRIA1CACNG8
SCHEMBL6989799 0.83 P2RX7 (0.40) P2RX7DHPSSRCDRD2KDM4E
SCHEMBL9836449 0.82 P2RX7 (0.54) P2RX7DHPSDRD2KDM4ELMNA
SCHEMBL9836689 0.78 CRBN (0.49) DHPSDRD2KDM4ELMNACHRM2
SCHEMBL18210028 0.77 SRC (0.41) DHPSSRCGRIA1CACNG8DRD2
SCHEMBL5366153 0.77 GRIA1 (0.42) GRIA1CACNG8DRD2KDM4ELMNA
SCHEMBL23252642 0.74 AHR (0.41) GRIA1CACNG8DRD2KDM4ELMNA
SCHEMBL687996 0.74 DRD2 (0.46) P2RX7GRIA1CACNG8DRD2KDM4E
SCHEMBL12335925 0.74 HTR1D (0.39) DHPSSRCGRIA1CACNG8DRD2
SCHEMBL4409544 0.74 CCNB2 (0.38) DHPSGRIA1CACNG8DRD2KDM4E

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 5 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
CN-86105309-A Oxindole-3-carbonyl amines the compound that replaces as the 1-of anti-inflammatory and anodyne 1987-01-14 CN disclosed