SCHEMBL4577206

SCHEMBL4577206

O=C(CCl)N1CCC(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.56
ALDH1A1 P00352 3/20 0.52
GPX4 P36969 1/20 0.51
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HTR2B P41595 1/20 0.50
MAPK14 Q16539 1/20 0.50
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
DRD4 P21917 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.47

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
SCHEMBL4576848 0.87 FAAH (0.55) CCR3ALDH1A1CYP2C9CYP2C19HTR2B
SCHEMBL4576925 0.87 MEN1 (0.60) CCR3ALDH1A1CYP2C9CYP2C19MAPK14
SCHEMBL2243090 0.86 ALDH1A1 (0.64) ALDH1A1CYP2C9CYP2C19HTR2BMAPK14
SCHEMBL4959434 0.84 ALDH1A1 (0.59) CCR3ALDH1A1CYP2C9CYP2C19HTR2B
SCHEMBL4578422 0.83 ALDH1A1 (0.57) CCR3ALDH1A1CYP2C9CYP2C19HTR2B
SCHEMBL2930984 0.79 TACR3 (0.57) CCR3ALDH1A1CYP2C9CYP2C19HTR2B
SCHEMBL8544747 0.77 MEN1 (0.52) RAB9ANPC1SMN1; SMN2
SCHEMBL7369921 0.76 ALDH1A1 (0.73) ALDH1A1GPX4SMN1; SMN2DRD4
SCHEMBL3155704 0.76 STS (0.56) CCR3ALDH1A1SMN1; SMN2
SCHEMBL94921 0.76 GAA (0.56) CCR3ALDH1A1CYP2C9CYP2C19HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7435744-B2 Piperidine derivatives as NMDA receptor antagonists GEDEON RICHTER VEGYESZETI GYAR RT (HU) 2008-10-14 US disclosed
US-20040157886-A1 Piperdine derivatives as NMDA receptor antagonists UCB Biopharma SRL (BE) 2004-08-12 US disclosed
EP-1409477-A1 PIPERIDINE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 2004-04-21 EP disclosed
WO-2003010159-A1 PIPERIDINE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2003-02-06 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-20040157886-A1 Piperdine derivatives as NMDA receptor antagonists GRIN1, GRIN2D, GRIN2C CCR3 672/4885ALDH1A1 1856/4885GPX4 2789/4885

“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.