SCHEMBL9666372

SCHEMBL9666372

CCN1C(=O)Cc2cc(C(C)=O)ccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.51
GAA P10253 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 5/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HPGD P15428 1/20 0.46
ATAD2 Q6PL18 1/20 0.46
BMPR1B O00238 1/20 0.44
BMPR1A P36894 1/20 0.44
TGFBR1 P36897 1/20 0.44
ACVRL1 P37023 1/20 0.44
ACVR1 Q04771 1/20 0.44
HSD17B1 P14061 1/20 0.42
KCNJ1 P48048 1/20 0.41
TP53 P04637 2/20 0.40
LMNA P02545 1/20 0.39
SMYD3 Q9H7B4 1/20 0.39
PDE5A O76074 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL9376138 0.88 POLB (0.51) BRD4GAAALDH1A1RAB9AATAD2
SCHEMBL7234123 0.87 BRD4 (0.50) BRD4GAAALDH1A1MAPTRAB9A
SCHEMBL9667697 0.84 BRD4 (0.51) BRD4GAAALDH1A1MAPTNPC1
SCHEMBL4894332 0.84 BRD4 (0.48) BRD4GAAALDH1A1MAPTNPC1
SCHEMBL7236659 0.83 MAPT (0.43) BRD4GAAALDH1A1MAPTNPC1
SCHEMBL9667595 0.83 ALDH1A1 (0.47) BRD4GAAALDH1A1MAPTNPC1
SCHEMBL9667528 0.83 BRD4 (0.47) BRD4GAAALDH1A1RAB9AHPGD
SCHEMBL9667208 0.83 SRD5A1 (0.51) BRD4GAAALDH1A1HPGD
SCHEMBL9667676 0.83 ATAD2 (0.48) BRD4GAAALDH1A1MAPTRAB9A
SCHEMBL9668299 0.82 BRD4 (0.46) BRD4GAAALDH1A1NPC1RAB9A

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-0181136-B1 OXINDOLE ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1992-03-25 EP disclosed
US-4686224-A Oxindole antiinflammatory agents PFIZER INC. (US) 1987-08-11 US disclosed
US-4644005-A ANTIARTHRITIC AGENTS PFIZER INC. (US) 1987-02-17 US disclosed
EP-0181136-A2 Oxindole antiinflammatory agents PFIZER INC. (US) 1986-05-14 EP disclosed