SCHEMBL5690532

SCHEMBL5690532

CN1CCN(c2cccc3c2CN(C(=O)c2ccc(Cl)cc2)CC3)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TMEM97 Q5BJF2 2/20 0.56
▸ SIGMAR1 Q99720 2/20 0.56
▸ POLB P06746 1/20 0.56
▸ CXCR3 P49682 4/20 0.55
▸ KMT2A Q03164 3/20 0.51
▸ MAPT P10636 3/20 0.47
▸ GAA P10253 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ USP2 O75604 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HSP90AB1 P08238 1/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ AVPR2 P30518 1/20 0.44
▸ AVPR1A P37288 1/20 0.44
▸ LMNA P02545 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL5690289 0.84 TMEM97 (0.53) TMEM97SIGMAR1CXCR3KMT2AMAPT
SCHEMBL5690806 0.83 TMEM97 (0.59) TMEM97SIGMAR1CXCR3KMT2AMAPT
SCHEMBL5689952 0.81 CXCR3 (0.57) TMEM97SIGMAR1CXCR3KMT2AMAPT
SCHEMBL5446306 0.81 TMEM97 (0.67) TMEM97SIGMAR1CXCR3HTR1AHTR1D
SCHEMBL5690320 0.81 ENPP2 (0.57) TMEM97SIGMAR1POLBCXCR3KMT2A
SCHEMBL14571502 0.80 CXCR3 (0.55) TMEM97SIGMAR1POLBCXCR3ALDH1A1
SCHEMBL5690040 0.78 ERCC1 (0.58) TMEM97SIGMAR1POLBCXCR3MAPT
SCHEMBL14591397 0.76 CXCR3 (0.56) TMEM97SIGMAR1CXCR3USP2TSHR
SCHEMBL5861502 0.76 TMEM97 (0.58) TMEM97SIGMAR1CXCR3KMT2AALDH1A1
SCHEMBL5861550 0.74 TMEM97 (0.59) TMEM97SIGMAR1CXCR3HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7101881-B2 Tetrahydroquinolines PFIZER INC (US) 2006-09-05 — — US claimed
EP-1641760-A2 NOVEL TETRAHYDROQUINOLINES Pfizer Products Inc. (US) 2006-04-05 — — EP claimed
WO-2004108682-A2 TETRAHYDROISOQUINOLINES AS ANTAGONISTS OF THE 5HT1B RECEPTOR PFIZER PRODUCTS INC. (US) 2004-12-16 — — WO claimed
US-20040254193-A1 Novel tetrahydroquinolines PFIZER INC 2004-12-16 — — US claimed
US-7101881-B2 Tetrahydroquinolines PFIZER INC (US) 2006-09-05 — — US disclosed
EP-1641760-A2 NOVEL TETRAHYDROQUINOLINES Pfizer Products Inc. (US) 2006-04-05 — — EP disclosed
WO-2004108682-A2 TETRAHYDROISOQUINOLINES AS ANTAGONISTS OF THE 5HT1B RECEPTOR PFIZER PRODUCTS INC. (US) 2004-12-16 — — WO disclosed
US-20040254193-A1 Novel tetrahydroquinolines PFIZER INC 2004-12-16 — — 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-20040254193-A1 Novel tetrahydroquinolines HTR5A, SLC18A2, HTR3B TMEM97 264/4885SIGMAR1 545/4885POLB 4401/4885

“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.

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