SCHEMBL4484794

SCHEMBL4484794

CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](c2ccccc2)C1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.57
GPR119 Q8TDV5 3/20 0.54
TACR1 P25103 3/20 0.52
USP30 Q70CQ3 3/20 0.51
JAK2 O60674 1/20 0.49
JAK1 P23458 1/20 0.49
KDM4E B2RXH2 1/20 0.49
PKM P14618 1/20 0.49
USP7 Q93009 2/20 0.49
STS P08842 1/20 0.46
NAMPT P43490 1/20 0.46
HPGDS O60760 1/20 0.45

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
SCHEMBL4489075 1.00 RORC (0.57) RORCGPR119TACR1USP30JAK2
SCHEMBL5923781 1.00 RORC (0.57) RORCGPR119TACR1USP30JAK2
SCHEMBL5923783 1.00 RORC (0.57) RORCGPR119TACR1USP30JAK2
SCHEMBL29960333 0.92 RORC (0.55) RORCGPR119TACR1USP30JAK2
SCHEMBL2242108 0.90 GPR119 (0.54) RORCGPR119TACR1USP30JAK2
SCHEMBL2246047 0.90 GPR119 (0.54) RORCGPR119TACR1USP30JAK2
SCHEMBL407256 0.90 GPR119 (0.54) RORCGPR119TACR1USP30JAK2
SCHEMBL23951332 0.88 RORC (0.64) RORCGPR119TACR1USP30KDM4E
SCHEMBL3991383 0.88 RORC (0.64) RORCGPR119TACR1USP30KDM4E
SCHEMBL17172484 0.88 RORC (0.64) RORCGPR119TACR1USP30KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7622487-B2 Piperidine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-24 US disclosed
EP-1748984-A1 PIPERIDINE DERIVATIVES AS NK1 AND NK3 ANTAGONISTS Pfizer Products Inc. (US) 2007-02-07 EP disclosed
US-20060167052-A1 Piperidine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-27 US disclosed
WO-2005110987-A1 PIPERIDINE DERIVATIVES AS NK1 AND NK3 ANTAGONISTS PFIZER PRODUCTS INC. (US) 2005-11-24 WO disclosed
US-20050256164-A1 NK1 and NK3 antagonists PFIZER INC 2005-11-17 US disclosed
EP-1553084-A1 PIPERIDINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2005-07-13 EP 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-20060167052-A1 Piperidine derivative, process for producing the same, and use OPRL1, OXTR, OPRM1 RORC 2424/4885GPR119 218/4885TACR1 6/4885
US-20050256164-A1 NK1 and NK3 antagonists TAC3, TACR1, TACR2 RORC 1418/4885GPR119 522/4885TACR1 2/4885

“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.