SCHEMBL6197542

SCHEMBL6197542

CCOC(=O)c1ccc(C2CCN(CCCN)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FDFT1 P37268 1/20 0.50
▸ HRH3 Q9Y5N1 4/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ SLC18A3 Q16572 1/20 0.46
▸ DRD2 P14416 2/20 0.46
▸ HTT P42858 1/20 0.45
▸ LMNA P02545 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ RAD52 P43351 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ MAOA P21397 1/20 0.44
▸ CACNA1F O60840 1/20 0.44
▸ BCHE P06276 1/20 0.44
▸ CACNA1D Q01668 1/20 0.44
▸ CACNA1S Q13698 1/20 0.44
▸ CACNA1C Q13936 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
SCHEMBL6198682 0.88 HRH1 (0.47) HRH3SLC18A3DRD2LMNAALDH1A1
SCHEMBL17389542 0.83 FDFT1 (0.58) FDFT1HTTLMNACYP1A2CYP3A4
SCHEMBL4003420 0.80 CA12 (0.59) FDFT1HTTLMNAALDH1A1SMN1; SMN2
SCHEMBL11827426 0.78 DRD2 (0.56) HRH3KCNH2DRD2CYP3A4
SCHEMBL3033970 0.78 FDFT1 (0.55) FDFT1HTTLMNAALDH1A1SMN1; SMN2
SCHEMBL21753148 0.78 FDFT1 (0.52) FDFT1HRH3KCNH2HTTALDH1A1
SCHEMBL28022173 0.77 FDFT1 (0.53) FDFT1HTTLMNAALDH1A1SMN1; SMN2
SCHEMBL15231639 0.77 FDFT1 (0.54) FDFT1HTTLMNAALDH1A1SMN1; SMN2
SCHEMBL3196580 0.77 HSD17B10 (0.53) HRH3KCNH2HTTLMNAALDH1A1
SCHEMBL12966086 0.76 KCNH2 (0.53) HRH3KCNH2DRD2

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
EP-1021185-A4 DIDHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 2005-09-07 — — EP disclosed
US-20020010186-A1 Dihydropyrimidines and uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2002-01-24 — — US disclosed
US-6268369-B1 ALPHA SUB 1 INHIBITORS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-07-31 — — US disclosed
EP-1021185-A1 DIDHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-07-26 — — EP disclosed
WO-1998051311-A2 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-11-19 — — WO disclosed
EP-0790826-A4 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 1998-11-11 — — EP disclosed
WO-1997042956-A1 DIDHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-11-20 — — WO disclosed
EP-0790826-A1 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-08-27 — — 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-20020010186-A1 Dihydropyrimidines and uses thereof QDPR, DPYD, ADRA1D FDFT1 202/4885HRH3 1172/4885KCNH2 423/4885

“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.

Send feedback