SCHEMBL15436944

SCHEMBL15436944

CC(C)(O)CN1CCC(N(C(=O)c2cc(-c3ccc(C#N)cc3F)on2)C2CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.51
SCD5 Q86SK9 1/20 0.51
ACKR3 P25106 14/20 0.43
GPR119 Q8TDV5 3/20 0.40
HSD11B1 P28845 1/20 0.39
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38

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
SCHEMBL15436996 0.94 SCD (0.50) SCDSCD5ACKR3GPR119HSD11B1
SCHEMBL15436983 0.87 S1PR1 (0.48) SCDSCD5ACKR3GPR119S1PR1
SCHEMBL15436968 0.86 SCD (0.40) SCDSCD5ACKR3GPR119HSD11B1
SCHEMBL15436984 0.85 SCD (0.48) SCDSCD5ACKR3GPR119HSD11B1
SCHEMBL15436977 0.85 GPR119 (0.58) SCDSCD5GPR119
SCHEMBL14238800 0.83 SCD (0.47) SCDSCD5ACKR3GPR119S1PR1
SCHEMBL15436969 0.82 SCD (0.53) SCDSCD5ACKR3S1PR1S1PR3
SCHEMBL15436995 0.81 S1PR1 (0.47) SCDSCD5GPR119HSD11B1S1PR1
SCHEMBL15437008 0.80 GPR119 (0.39) SCDSCD5ACKR3GPR119HSD11B1
SCHEMBL14990348 0.79 SCD (0.47) SCDSCD5ACKR3GPR119S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2877464-B1 N-CYCLOPROPYL-N-PIPERIDINYL-AMIDE DERIVATIVES AND THEIR USE AS GPR119 MODULATORS BOEHRINGER INGELHEIM INT (DE) 2016-08-24 EP disclosed
EP-2877464-B1 N-CYCLOPROPYL-N-PIPERIDINYL-AMIDE DERIVATIVES AND THEIR USE AS GPR119 MODULATORS BOEHRINGER INGELHEIM INT (DE) 2016-08-24 EP disclosed
EP-2877464-A1 N-CYCLOPROPYL-N-PIPERIDINYL-AMIDE DERIVATIVES AND THEIR USE AS GPR119 MODULATORS Boehringer Ingelheim International GmbH (DE) 2015-06-03 EP disclosed
US-8927726-B2 N-cyclopropyl-N-piperidinyl-amide derivatives, pharmaceutical compositions containing them and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-01-06 US disclosed
US-8927726-B2 N-cyclopropyl-N-piperidinyl-amide derivatives, pharmaceutical compositions containing them and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-01-06 US disclosed
US-8927726-B2 N-cyclopropyl-N-piperidinyl-amide derivatives, pharmaceutical compositions containing them and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-01-06 US disclosed
WO-2014016191-A1 N-CYCLOPROPYL-N-PIPERIDINYL-AMIDE DERIVATIVES AND THEIR USE AS GPR119 MODULATORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-30 WO disclosed
US-20140031369-A1 N-CYCLOPROPYL-N-PIPERIDINYL-AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND USES THEREOF NEUROCRINE BIOSCIENCES, INC. (US) 2014-01-30 US disclosed
US-20140031369-A1 N-CYCLOPROPYL-N-PIPERIDINYL-AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND USES THEREOF NEUROCRINE BIOSCIENCES, INC. (US) 2014-01-30 US disclosed
US-20140031369-A1 N-CYCLOPROPYL-N-PIPERIDINYL-AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND USES THEREOF NEUROCRINE BIOSCIENCES, INC. (US) 2014-01-30 US 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-20140031369-A1 N-CYCLOPROPYL-N-PIPERIDINYL-AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND USES THEREOF GPR119, GPR88, CNR1 SCD 1100/4885SCD5 1057/4885ACKR3 252/4885

“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.