SCHEMBL699288

SCHEMBL699288

O=S(=O)(c1cccc(F)c1)N1CCCc2c[c]ccc21

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.57
CYP11B2 P19099 3/20 0.57
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
ATM Q13315 1/20 0.52
AKR1C3 P42330 1/20 0.50
NR1H3 Q13133 4/20 0.49
RORC P51449 6/20 0.48
NR1I2 O75469 2/20 0.48
NR1H2 P55055 2/20 0.48
NR3C1 P04150 1/20 0.44
AR P10275 1/20 0.44
RORA P35398 1/20 0.44
RORB Q92753 1/20 0.44
NR1H4 Q96RI1 1/20 0.44

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
SCHEMBL698681 0.85 CYP11B1 (0.59) CYP11B1CYP11B2KMT2AMEN1ATM
SCHEMBL695513 0.85 NR1H3 (0.58) CYP11B1CYP11B2KMT2AMEN1ATM
SCHEMBL10186904 0.84 KMT2A (0.72) CYP11B1CYP11B2KMT2AMEN1ATM
SCHEMBL16354308 0.77 CYP11B1 (0.50) CYP11B1CYP11B2KMT2AMEN1ATM
SCHEMBL693950 0.77 NR1H3 (0.57) CYP11B1CYP11B2KMT2AMEN1NR1H3
SCHEMBL2691934 0.76 KMT2A (0.72) CYP11B1CYP11B2KMT2AMEN1ATM
SCHEMBL698427 0.74 TP53 (0.44) KMT2AMEN1
SCHEMBL17710370 0.71 KMT2A (0.67) KMT2AMEN1ATMAKR1C3
SCHEMBL30015188 0.71 CPT1A (0.74) NR1H3RORCNR1I2NR1H2NR3C1
SCHEMBL3570983 0.71 CPT1A (0.74) NR1H3RORCNR1I2NR1H2NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962607-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2015-02-24 US claimed
EP-2421823-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-01-14 EP claimed
US-20140243305-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (US) 2014-08-28 US claimed
US-8445477-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2013-05-21 US claimed
US-20100324012-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-23 US claimed
US-8962607-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2015-02-24 US disclosed
EP-2421823-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-01-14 EP disclosed
US-20140243305-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (US) 2014-08-28 US disclosed
US-8445477-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2013-05-21 US disclosed
EP-2421823-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP disclosed
US-20100324012-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-23 US disclosed
WO-2010124086-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140243305-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA CYP11B1 2616/4885CYP11B2 2915/4885KMT2A 1573/4885
US-20100324012-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA CYP11B1 2616/4885CYP11B2 2915/4885KMT2A 1573/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.