SCHEMBL4869898

SCHEMBL4869898

OC1CCN1Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.58
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.49
SIGMAR1 Q99720 3/20 0.48
FUCA1 P04066 2/20 0.47
ACHE P22303 1/20 0.47
CCR3 P51677 1/20 0.46

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
Methane SCHEMBL28108223 0.98 GBA1 (0.57) GBA1ALDH1A1MAPTSIGMAR1FUCA1
SCHEMBL1844987 0.89 ALDH1A1 (0.56) GBA1ALDH1A1MAPTSIGMAR1
SCHEMBL2433049 0.89 ALDH1A1 (0.56) GBA1ALDH1A1MAPTSIGMAR1
SCHEMBL2230942 0.87 GBA1 (0.50) GBA1ALDH1A1
Methane SCHEMBL6969354 0.87 ALDH1A1 (0.54) GBA1ALDH1A1MAPT
SCHEMBL2763581 0.85 GBA1 (0.53) GBA1ALDH1A1MAPTSIGMAR1FUCA1
Methane SCHEMBL7288556 0.85 GBA1 (0.49) GBA1ALDH1A1
SCHEMBL5743634 0.81 MAPT (0.58) GBA1ALDH1A1MAPTSIGMAR1FUCA1
SCHEMBL2430189 0.81 GBA1 (0.64) GBA1ALDH1A1MAPTSIGMAR1FUCA1
SCHEMBL2885978 0.79 SIGMAR1 (0.54) GBA1SIGMAR1ACHECCR3

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-20080261945-A1 Compounds Having Activity at Nk3 Receptor and Uses Thereof in Medicine SMITHKLINE BEECHAM CORPORATION (US) 2008-10-23 US disclosed
EP-1812398-A1 COMPOUNDS HAVING ACTIVITY AT NK3 RECEPTOR AND USES THEREOF IN MEDICINE SmithKline Beecham Corporation (US) 2007-08-01 EP disclosed
WO-2006050992-A1 COMPOUNDS HAVING ACTIVITY AT NK3 RECEPTOR AND USES THEREOF IN MEDICINE SMITHKLINE BEECHAM CORPORATION (US) 2006-05-18 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-20080261945-A1 Compounds Having Activity at Nk3 Receptor and Uses Thereof in Medicine CNR1, ACKR3, HCAR3 GBA1 423/4885ALDH1A1 704/4885MAPT 4608/4885

“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.