SCHEMBL2178205

SCHEMBL2178205

NC1CCN(C(CCc2ccccc2)c2ccccc2)CC1O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.53
DPP4 P27487 1/20 0.41
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.39
TSHR P16473 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
CYP2C19 P33261 1/20 0.38
POLB P06746 1/20 0.37
CCR3 P51677 1/20 0.37
SLC18A3 Q16572 1/20 0.37
SLC6A2 P23975 1/20 0.37

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
SCHEMBL2178201 1.00 SLC6A4 (0.53) SLC6A4DPP4CYP1A2CYP3A4CYP2D6
SCHEMBL2178207 1.00 SLC6A4 (0.53) SLC6A4DPP4CYP1A2CYP3A4CYP2D6
SCHEMBL2179868 0.85 OPRM1 (0.50) DPP4TSHR
SCHEMBL2179875 0.85 OPRM1 (0.50) DPP4TSHR
SCHEMBL2179872 0.85 OPRM1 (0.50) DPP4TSHR
SCHEMBL2180519 0.84 DPP4 (0.48) DPP4
SCHEMBL2180514 0.84 DPP4 (0.48) DPP4
SCHEMBL2180510 0.84 DPP4 (0.48) DPP4
SCHEMBL2179644 0.76 CYP2D6 (0.51) DPP4CYP2D6KDM4E
SCHEMBL2179651 0.76 CYP2D6 (0.51) DPP4CYP2D6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110166357-A1 METHOD FOR PRODUCING N-SUBSTITUTED-TRANS-4-AZIDOPIPERIDINE-3-OL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-07 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-20110166357-A1 METHOD FOR PRODUCING N-SUBSTITUTED-TRANS-4-AZIDOPIPERIDINE-3-OL RPS27L, OSGEP, RPLP1 SLC6A4 524/4885DPP4 4436/4885CYP1A2 86/4885

“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.