SCHEMBL790466

SCHEMBL790466

CS(=O)(=O)c1ccc(NC2CCN(C3CCN(c4ncc(Cl)nc4Cl)CC3)C2=O)cn1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 13/20 0.37
FPR2 P25090 1/20 0.35
GPR119 Q8TDV5 2/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
CD69 Q07108 2/20 0.30
SMO Q99835 2/20 0.30
CYP3A4 P08684 1/20 0.30
TEC P42680 1/20 0.30
TXK P42681 1/20 0.30
BMX P51813 1/20 0.30
ITK Q08881 1/20 0.30

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
SCHEMBL790465 1.00 BTK (0.37) BTKFPR2GPR119HDAC1HDAC8
SCHEMBL2597003 0.85 GPR119 (0.36) BTKFPR2GPR119SMO
SCHEMBL2597004 0.85 GPR119 (0.36) BTKFPR2GPR119SMO
SCHEMBL15023394 0.84 BTK (0.39) BTKGPR119CD69SMOCYP3A4
SCHEMBL12185888 0.84 BTK (0.39) BTKGPR119CD69SMOCYP3A4
SCHEMBL15023727 0.82 SMN1; SMN2 (0.46)
SCHEMBL15023725 0.82 SMN1; SMN2 (0.46)
SCHEMBL2597021 0.80 GPR119 (0.38) BTKGPR119CYP3A4
SCHEMBL2597022 0.80 GPR119 (0.38) BTKGPR119CYP3A4
SCHEMBL789988 0.80 GPR119 (0.40) BTKFPR2GPR119HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754226-B2 Piperidinyl-substituted lactams as GPR119 modulators ARRAY BIOPHARMA INC. (US) 2014-06-17 US disclosed
EP-2616074-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-07-24 EP disclosed
US-20130184257-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA, INC. 2013-07-18 US disclosed
US-20130158009-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA, INC. 2013-06-20 US disclosed
EP-2571864-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-03-27 EP disclosed
WO-2012037393-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2012-03-22 WO disclosed
WO-2011146335-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2011-11-24 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-20130158009-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS GPR119, GPR139, GPR39 BTK 3330/4885FPR2 328/4885GPR119 1/4885
US-20130184257-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS GPR119, GPR139, GPR180 BTK 3212/4885FPR2 192/4885GPR119 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.