SCHEMBL21885670

SCHEMBL21885670

CC(C)(C)OC(=O)N1CCC(c2ccccc2Br)CC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.55
NAMPT P43490 1/20 0.52
KDM4E B2RXH2 2/20 0.51
THRB P10828 2/20 0.51
MAPT P10636 1/20 0.51
PKM P14618 1/20 0.50
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
PTPN6 P29350 1/20 0.48
HPGDS O60760 1/20 0.47
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
STS P08842 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL30436742 1.00 GPR119 (0.55) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL28334298 0.92 GPR119 (0.50) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL3436365 0.86 GPR119 (0.58) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL21953943 0.85 GPR119 (0.56) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL1613087 0.85 GPR119 (0.56) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL21352374 0.84 GPR119 (0.55) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL21885666 0.84 GPR119 (0.55) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL30534946 0.84 GPR119 (0.55) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL73493 0.84 GPR119 (0.55) GPR119NAMPTKDM4ETHRBMAPT
SCHEMBL2160640 0.84 MEN1 (0.57) GPR119NAMPTKDM4ETHRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3784655-B1 PROCESS FOR PREPARING 2-(1-(TERT-BUTOXYCARBONYL)PIPERIDINE-4-YL)BENZOIC ACID THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-10-04 EP disclosed
EP-3784655-B1 PROCESS FOR PREPARING 2-(1-(TERT-BUTOXYCARBONYL)PIPERIDINE-4-YL)BENZOIC ACID THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-10-04 EP disclosed
CN-112204007-B Process for preparing 2- (1- (tert-butoxycarbonyl) piperidin-4-yl) benzoic acid 施万生物制药研发IP有限责任公司 2023-06-20 CN disclosed
WO-2023078127-A1 MACROCYCLIC SULFONAMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF 中国药科大学 2023-05-11 WO disclosed
CN-112204007-A Process for the preparation of 2- (1- (tert-butoxycarbonyl) piperidin-4-yl) benzoic acid 施万生物制药研发IP有限责任公司 2021-01-08 CN disclosed
US-10640467-B2 Process for preparing 2-(1-(tert-butoxycarbonyl)piperidine-4-yl)benzoic acid THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-05-05 US disclosed
US-10640467-B2 Process for preparing 2-(1-(tert-butoxycarbonyl)piperidine-4-yl)benzoic acid THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-05-05 US disclosed
CN-100389113-C Nitrogen-containing heterocyclic compound and drug containing same EISAI CO LTD (JP) 2008-05-21 CN disclosed
CN-1630650-A Nitrogen-containing heterocyclic compound and drug containing same EISAI CO LTD (JP) 2005-06-22 CN 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-10640467-B2 Process for preparing 2-(1-(tert-butoxycarbonyl)piperidine-4-yl)benzoic acid BDNF, GABRE, NPY5R GPR119 499/4885NAMPT 868/4885KDM4E 362/4885

“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.