SCHEMBL1574487

SCHEMBL1574487

Clc1ccc(CC=C2CCNCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.42
HTR2B P41595 6/20 0.42
HTR2A P28223 4/20 0.40
HTR3A P46098 3/20 0.40
SIGMAR1 Q99720 2/20 0.40
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
ADRB1 P08588 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
MLNR O43193 1/20 0.38
CETP P11597 1/20 0.36
HTR7 P34969 3/20 0.36
HTR6 P50406 2/20 0.36
HTR1D P28221 1/20 0.35
HTR1E P28566 1/20 0.35
IDO1 P14902 1/20 0.34
PNMT P11086 1/20 0.34
DRD2 P14416 1/20 0.34
LTA4H P09960 1/20 0.34

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
SCHEMBL1574293 0.81 HTR2C (0.42) HTR2CHTR2BHTR2AHTR3AMLNR
SCHEMBL15536798 0.80 BCHE (0.44) MLNR
Hydrochloric Acid SCHEMBL1574477 0.80 SIGMAR1 (0.45) SIGMAR1ADRB1HTR6IDO1PNMT
Hydrochloric Acid SCHEMBL1574246 0.79 MAOB (0.41) HTR2CHTR2BHTR2AHTR3ASIGMAR1
Hydrochloric Acid SCHEMBL9256860 0.76 ALDH1A1 (0.41) MLNR
SCHEMBL13939515 0.75 DPP7 (0.44) HTR2CHTR2BHTR2AHTR3ASIGMAR1
SCHEMBL25344328 0.71 HTR2C (0.53) HTR2CHTR2BHTR2AHTR3ASIGMAR1
SCHEMBL16322736 0.71 HTR2C (0.48) HTR2CHTR2BHTR2AHTR3ASIGMAR1
SCHEMBL29366568 0.70 ALDH1A1 (0.36) HTR3ASIGMAR1HTR3EHTR3BADRB1
Hydrochloric Acid SCHEMBL4887672 0.69 HTR2C (0.47) HTR2CHTR2BHTR2AHTR3ASIGMAR1

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-8618133-B2 Aralkyl alcohol pyridine derivative compounds and the use thereof as medicaments for treating depression JIANGSU HENGYI PHARMACEUTICAL CO., LTD. (CN) 2013-12-31 US disclosed
US-20110160247-A1 Aralkyl alcohol piperidine derivative and the use thereof as a medicament for treating depression JIANGSU GOWORTH INVESTMENT CO. LTD (CN) 2011-06-30 US disclosed
EP-2305644-A1 ARALKYL ALCOHOL PIPERIDINE DERIVATIVE AND THE USE AS MEDICAMENT FOR TREATING DEPRESSION THEREOF Jiangsu Goworth Investment Co. Ltd (CN) 2011-04-06 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 (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-20110160247-A1 Aralkyl alcohol piperidine derivative and the use thereof as a medicament for treating depression DRD4, DRD5, DRD3 HTR2C 22/4885HTR2B 38/4885HTR2A 16/4885

“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.