SCHEMBL789930

SCHEMBL789930

CS(=O)(=O)c1ccc(N[C@H]2CCN(C3CCN(C(=N)NO)CC3)C2=O)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
GPR119 Q8TDV5 14/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
SLC6A9 P48067 3/20 0.35
ROCK2 O75116 1/20 0.34

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
SCHEMBL789423 0.87 HDAC1 (0.35) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL789145 0.87 GPR119 (0.42) CYP3A4CYP2C9GPR119HDAC1HDAC8
Iodomethane SCHEMBL795775 0.86 GPR119 (0.41) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL789247 0.84 GPR119 (0.39) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL789215 0.82 FPR2 (0.41) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL2597001 0.82 FPR2 (0.41) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL15105289 0.82 BTK (0.33) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL795708 0.82 GPR119 (0.42) CYP3A4CYP2C9GPR119SLC6A9
SCHEMBL790109 0.82 CYP3A4 (0.36) CYP3A4CYP2C9GPR119HDAC1HDAC8
SCHEMBL789168 0.82 CYP3A4 (0.36) CYP3A4CYP2C9GPR119HDAC1HDAC8

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.