SCHEMBL9434692

SCHEMBL9434692

CCC(=O)Nc1cc(Cl)ccc1Oc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 11/20 0.70
MAPK1 P28482 2/20 0.70
TP53 P04637 1/20 0.70
HTT P42858 1/20 0.69
KMT2A Q03164 3/20 0.68
MEN1 O00255 2/20 0.68
POLB P06746 1/20 0.68
CYP1A2 P05177 1/20 0.68
CYP3A4 P08684 1/20 0.68
CYP2C9 P11712 1/20 0.68
CYP2C19 P33261 1/20 0.68
LMNA P02545 6/20 0.67
NPSR1 Q6W5P4 6/20 0.65
MAPT P10636 4/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
GAA P10253 2/20 0.64
ALDH1A1 P00352 5/20 0.64
THRB P10828 1/20 0.64

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
SCHEMBL9434834 0.90 L3MBTL1 (0.67) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL11782499 0.88 L3MBTL1 (0.72) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL21392893 0.88 L3MBTL1 (0.71) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL7924804 0.86 L3MBTL1 (0.70) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL8787198 0.85 L3MBTL1 (0.64) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL15911145 0.83 L3MBTL1 (0.63) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL7720888 0.83 L3MBTL1 (0.74) L3MBTL1KMT2AMEN1POLBLMNA
SCHEMBL11045465 0.82 L3MBTL1 (0.62) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL3518000 0.82 KMT2A (0.66) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL14192656 0.81 KMT2A (0.82) KMT2AMEN1POLBCYP1A2CYP2C19

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
US-5324722-A Analgesics G. D. SEARLE & CO. (US) 1994-06-28 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