SCHEMBL790109

SCHEMBL790109

CS(=O)(=O)c1ccc(N[C@H]2CCN(C3CCN(C#N)CC3)C2=O)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
GPR119 Q8TDV5 11/20 0.35
UCHL1 P09936 1/20 0.34
USP30 Q70CQ3 3/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
F10 P00742 1/20 0.33
ROCK2 O75116 1/20 0.33

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
SCHEMBL789168 1.00 CYP3A4 (0.36) CYP3A4CYP2C9GPR119UCHL1USP30
SCHEMBL15105646 0.87 BTK (0.36) UCHL1USP30HDAC1HDAC8HDAC6
SCHEMBL790144 0.87 BTK (0.36) UCHL1USP30HDAC1HDAC8HDAC6
SCHEMBL2597001 0.85 FPR2 (0.41) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL789215 0.85 FPR2 (0.41) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL789145 0.84 GPR119 (0.42) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL15023779 0.83 GPR119 (0.45) CYP3A4CYP2C9GPR119
SCHEMBL12185791 0.83 GPR119 (0.45) CYP3A4CYP2C9GPR119
Iodomethane SCHEMBL795775 0.82 GPR119 (0.41) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL12185919 0.82 MAPT (0.43) CYP3A4CYP2C9GPR119F10

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-2616074-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-07-24 EP disclosed
CN-103221046-A Piperidinyl-substituted lactams as gpr119 modulators ARRAY BIOPHARMA INC 2013-07-24 CN disclosed
US-20130184257-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA, INC. 2013-07-18 US disclosed
WO-2012037393-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2012-03-22 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 (1 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-20130184257-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS GPR119, GPR139, GPR180 CYP3A4 2241/4885CYP2C9 975/4885GPR119 1/4885

“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.