SCHEMBL9434834

SCHEMBL9434834

CCCC(=O)Nc1cc(Cl)ccc1Oc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 10/20 0.67
MAPK1 P28482 2/20 0.67
TP53 P04637 1/20 0.67
HTT P42858 1/20 0.66
KMT2A Q03164 3/20 0.65
MEN1 O00255 2/20 0.65
POLB P06746 2/20 0.65
CYP1A2 P05177 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2C9 P11712 1/20 0.65
CYP2C19 P33261 1/20 0.65
SMN1; SMN2 Q16637 5/20 0.65
LMNA P02545 5/20 0.65
NPSR1 Q6W5P4 5/20 0.64
ALDH1A1 P00352 5/20 0.64
MAPT P10636 3/20 0.64
GAA P10253 2/20 0.64
THRB P10828 1/20 0.61
ATM Q13315 1/20 0.61
MTNR1B P49286 1/20 0.59

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
SCHEMBL9434692 0.90 L3MBTL1 (0.70) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL11782499 0.86 L3MBTL1 (0.72) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL21392893 0.85 L3MBTL1 (0.71) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL3518000 0.85 KMT2A (0.66) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL7924804 0.84 L3MBTL1 (0.70) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL30380117 0.82 MTNR1B (0.60) L3MBTL1MAPK1HTTPOLBCYP1A2
SCHEMBL8787198 0.82 L3MBTL1 (0.64) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL11045465 0.80 L3MBTL1 (0.62) L3MBTL1MAPK1TP53HTTKMT2A
SCHEMBL15926354 0.77 L3MBTL1 (0.81) L3MBTL1HTTKMT2AMEN1POLB
SCHEMBL18666229 0.76 POLB (1.00) L3MBTL1KMT2AMEN1POLBCYP2C19

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