SCHEMBL7121516

SCHEMBL7121516

Cc1ccc([C@H]2CCN[C@H](C)C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.42
MAPT P10636 2/20 0.42
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
P2RY14 Q15391 1/20 0.39
HTR2C P28335 4/20 0.38
PRCP P42785 1/20 0.38
GID4 Q8IVV7 1/20 0.37
F2 P00734 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
SLC18A3 Q16572 2/20 0.36
SIGMAR1 Q99720 1/20 0.35
HTR3A P46098 1/20 0.35
KDM1A O60341 1/20 0.35

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
SCHEMBL7121523 1.00 PLG (0.42) PLGMAPTATMNPSR1P2RY14
SCHEMBL7121518 1.00 PLG (0.42) PLGMAPTATMNPSR1P2RY14
SCHEMBL30608334 0.83 PLG (0.41) PLGMAPTP2RY14HTR2CCYP3A4
SCHEMBL13161383 0.83 HTR3A (0.55) PLGP2RY14HTR2CPRCPHTR3A
SCHEMBL5011948 0.82 SLC18A3 (0.55) PLGP2RY14SLC18A3SIGMAR1
Hydrochloric Acid SCHEMBL2159262 0.81 HTR3A (0.53) PLGP2RY14HTR2CHTR3A
SCHEMBL23858275 0.80 HTR2C (0.64) PLGP2RY14HTR2CKDM1A
SCHEMBL12488729 0.80 KCNH2 (0.46) PLGP2RY14HTR2C
SCHEMBL23873227 0.80 HTR2C (0.46) PLGP2RY14HTR2C
SCHEMBL18618469 0.80 KDM1A (0.44) PLGHTR2CGID4KDM1A

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-20030092733-A1 Process for preparing trans-2,4-disubstituted piperidines ELI LILLY AND COMPANY 2003-05-15 US disclosed
EP-1244622-A1 A PROCESS FOR PREPARING TRANS-2,4-DISUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY (US) 2002-10-02 EP disclosed
WO-2001046143-A1 A PROCESS FOR PREPARING TRANS-2,4-DISUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY (US) 2001-06-28 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-20030092733-A1 Process for preparing trans-2,4-disubstituted piperidines CYP4B1, CYP1A1, CYP3A4 PLG 4063/4885MAPT 2868/4885ATM 4186/4885

“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.