SCHEMBL8787198

SCHEMBL8787198

CC(=O)Nc1cc(Cl)ccc1Oc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 12/20 0.64
LMNA P02545 6/20 0.64
NPSR1 Q6W5P4 4/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
MAPK1 P28482 2/20 0.63
TP53 P04637 1/20 0.63
MAPT P10636 3/20 0.63
HTT P42858 1/20 0.62
KMT2A Q03164 3/20 0.62
MEN1 O00255 2/20 0.62
POLB P06746 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
ALDH1A1 P00352 3/20 0.58
THRB P10828 1/20 0.58
GAA P10253 1/20 0.56

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
SCHEMBL11782499 0.86 L3MBTL1 (0.72) L3MBTL1LMNANPSR1SMN1; SMN2MAPK1
SCHEMBL11045465 0.86 L3MBTL1 (0.62) L3MBTL1LMNANPSR1SMN1; SMN2MAPK1
SCHEMBL9434692 0.85 L3MBTL1 (0.70) L3MBTL1LMNANPSR1SMN1; SMN2MAPK1
SCHEMBL11325646 0.84 MAPT (0.55) LMNANPSR1MAPTHTTCYP1A2
SCHEMBL10416922 0.84 NPSR1 (0.50) L3MBTL1LMNANPSR1SMN1; SMN2MAPK1
SCHEMBL21392893 0.83 L3MBTL1 (0.71) L3MBTL1LMNANPSR1SMN1; SMN2MAPK1
SCHEMBL9434834 0.82 L3MBTL1 (0.67) L3MBTL1LMNANPSR1SMN1; SMN2MAPK1
SCHEMBL1638973 0.82 L3MBTL1 (0.57) L3MBTL1LMNANPSR1SMN1; SMN2MAPT
SCHEMBL16316797 0.82 L3MBTL1 (0.56) L3MBTL1LMNANPSR1SMN1; SMN2MAPT
SCHEMBL7924804 0.82 L3MBTL1 (0.70) L3MBTL1LMNANPSR1SMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0534667-B1 Tricyclic heterocycles as PGE2 antagonists ZENECA LTD (GB) 1997-02-05 EP disclosed
EP-0480641-B1 Tricyclic heterocycles ZENECA LTD (GB) 1995-04-05 EP disclosed
US-5324722-A Analgesics G. D. SEARLE & CO. (US) 1994-06-28 US disclosed
US-5317101-A Antihyperalgesics IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-05-31 US disclosed
WO-1993013082-A1 SUBSTITUTED DIBENZOXAZEPINES OR DIBENZOTHIAZEPINES AND THEIR USE AS PROSTAGLANDIN E2 ANTAGONISTS G.D. SEARLE & CO. (US) 1993-07-08 WO disclosed
EP-0534667-A1 Tricyclic heterocycles as PGE2 antagonists ZENECA LIMITED (GB) 1993-03-31 EP disclosed
US-5189033-A Analgesics, antiiflammatory agents IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-02-23 US disclosed
EP-0480641-A1 Tricyclic heterocycles ZENECA LIMITED (GB) 1992-04-15 EP disclosed