SCHEMBL6352033

SCHEMBL6352033

NCCCP(=O)(O)C(O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.65
POLB P06746 2/20 0.50
ALDH1A1 P00352 1/20 0.49
TSHR P16473 1/20 0.49
GRM4 Q14833 9/20 0.48
GRM8 O00222 7/20 0.48
GRM7 Q14831 1/20 0.48
GRM6 O15303 2/20 0.47
HRH1 P35367 2/20 0.46
HTR2A P28223 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
Hydrochloric Acid SCHEMBL9336355 0.98 CYP2D6 (0.63) CYP2D6POLBALDH1A1TSHRGRM4
SCHEMBL16473696 0.83 POLB (0.47) CYP2D6POLBALDH1A1TSHRHRH1
SCHEMBL16473708 0.79 CYP2D6 (0.52) CYP2D6POLBALDH1A1TSHRGRM4
SCHEMBL12858790 0.79 CYP2D6 (0.65) CYP2D6POLBALDH1A1TSHRGRM4
SCHEMBL16473728 0.78 GRM4 (0.45) CYP2D6GRM4GRM8GRM7GRM6
SCHEMBL16473712 0.78 KDM4E (0.48) CYP2D6GRM4GRM8GRM7GRM6
SCHEMBL16473737 0.78 GRM4 (0.45) CYP2D6ALDH1A1GRM4GRM8GRM7
SCHEMBL16473700 0.78 GRM8 (0.71) ALDH1A1TSHRGRM4GRM8GRM6
SCHEMBL10000484 0.77 GRM4 (0.53) GRM4GRM8GRM6
SCHEMBL17339775 0.77 ALOX15 (0.52) CYP2D6ALDH1A1TSHRGRM4GRM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1372620-A2 METHODS FOR RESTORING COGNITIVE FUNCTION FOLLOWING SYSTEMIC STRESS Saegis Pharmaceuticals (US) 2004-01-02 EP claimed
US-20020187977-A1 Methods for restoring cognitive function following systemic stress SAEGIS PHARMACEUTICALS, INC. 2002-12-12 US claimed
WO-2002074293-A2 METHODS FOR RESTORING COGNITIVE FUNCTION FOLLOWING SYSTEMIC STRESS SAEGIS PHARMACEUTICALS INC (US) 2002-09-26 WO claimed
EP-0319482-B1 Novel substituted propane phosphinic acid compounds CIBA GEIGY AG (CH) 1994-05-18 EP claimed
EP-0319479-A2 Substituted propane-phosphinic acid compounds CIBA-GEIGY AG (CH) 1989-06-07 EP claimed
EP-0319482-A2 Novel substituted propane phosphinic acid compounds CIBA-GEIGY AG (CH) 1989-06-07 EP claimed
US-20050222093-A1 Methods for restoring cognitive function following systemic stress PEARLMAN RODNEY 2005-10-06 US disclosed
US-20020187977-A1 Methods for restoring cognitive function following systemic stress SAEGIS PHARMACEUTICALS, INC. 2002-12-12 US disclosed
EP-0319482-B1 Novel substituted propane phosphinic acid compounds CIBA GEIGY AG (CH) 1994-05-18 EP disclosed
EP-0319479-A2 Substituted propane-phosphinic acid compounds CIBA-GEIGY AG (CH) 1989-06-07 EP disclosed
EP-0319482-A2 Novel substituted propane phosphinic acid compounds CIBA-GEIGY AG (CH) 1989-06-07 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 (2 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-20050222093-A1 Methods for restoring cognitive function following systemic stress CRH, BDNF, CHAT CYP2D6 3905/4885POLB 3463/4885ALDH1A1 2280/4885
US-20020187977-A1 Methods for restoring cognitive function following systemic stress CRH, BDNF, CHAT CYP2D6 3905/4885POLB 3463/4885ALDH1A1 2280/4885

“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.