SCHEMBL5223921

SCHEMBL5223921

Cc1cc(F)ccc1[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1N(C)C(=O)OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
SIGMAR1 Q99720 1/20 0.44
GPR119 Q8TDV5 1/20 0.43
TACR1 P25103 12/20 0.42
USP30 Q70CQ3 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL5223912 1.00 JAK2 (0.45) JAK2JAK1SIGMAR1GPR119TACR1
SCHEMBL5223918 1.00 JAK2 (0.45) JAK2JAK1SIGMAR1GPR119TACR1
SCHEMBL26399598 0.89 SIGMAR1 (0.48) SIGMAR1TACR1CYP3A4CYP2D6CYP2C9
SCHEMBL12435283 0.89 SIGMAR1 (0.48) SIGMAR1TACR1CYP3A4CYP2D6CYP2C9
SCHEMBL22721969 0.87 SIGMAR1 (0.43) SIGMAR1TACR1CYP3A4CYP2D6CYP2C9
SCHEMBL5221681 0.83 GPR119 (0.47) JAK2JAK1GPR119TACR1USP30
SCHEMBL5227765 0.83 GPR119 (0.47) JAK2JAK1GPR119TACR1USP30
SCHEMBL5226606 0.83 GPR119 (0.47) JAK2JAK1GPR119TACR1USP30
SCHEMBL30368581 0.82 SIGMAR1 (0.52) JAK2JAK1SIGMAR1GPR119USP30
SCHEMBL14372572 0.79 TACR1 (0.43) TACR1USP30CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244158-A1 Piperdine Compound and Process for Preparing the Same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-10-18 US disclosed
EP-1789389-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2007-05-30 EP disclosed
WO-2006030984-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2006-03-23 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-20070244158-A1 Piperdine Compound and Process for Preparing the Same AVPR1B, PRLHR, HRH4 JAK2 135/4885JAK1 1097/4885SIGMAR1 146/4885

“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.