SCHEMBL7633647

SCHEMBL7633647

COc1ccc(-c2ccccc2CN2CCN(CCOCCOCC(N)=O)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 7/20 0.53
HRH3 Q9Y5N1 1/20 0.50
F10 P00742 3/20 0.46
HTR1A P08908 5/20 0.46
F2 P00734 1/20 0.46
CTRB1 P17538 1/20 0.46
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
FAAH O00519 1/20 0.43
ACHE P22303 1/20 0.43

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
SCHEMBL11125568 0.98 HTR7 (0.54) HTR7HRH3F10HTR1AF2
Hydrochloric Acid SCHEMBL10931643 0.97 HTR7 (0.53) HTR7HRH3F10HTR1AF2
SCHEMBL7628259 0.88 HTR7 (0.48) HTR7HRH3KDM4EMEN1ALDH1A1
Hydrochloric Acid SCHEMBL10930120 0.87 HTR7 (0.47) HTR7HRH3KDM4EMEN1ALDH1A1
SCHEMBL1569359 0.85 HTR7 (0.50) HTR7HRH3KDM4EALDH1A1TDP1
SCHEMBL10932211 0.85 HRH3 (0.48) HTR7HRH3HTR1AKDM4EMEN1
SCHEMBL10928076 0.85 TACR1 (0.48) HTR7HRH3HTR1AKDM4EMEN1
SCHEMBL11037599 0.80 HTR7 (0.41) HTR7HRH3F10HTR1AF2
Hydrochloric Acid SCHEMBL11037586 0.79 HTR7 (0.41) HTR7HRH3F10HTR1AF2
SCHEMBL7630560 0.78 HTR7 (0.48) HTR7HRH3HTR1AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6469009-B1 MIXTURE CONSISTING ESSENTIALLY OF PSEUDOEPHEDRINE AND COMPOUND SELECTED FROM 2-(4-(DIPHENYLMETHYL)-1-PIPERAZINYL)-ACETIC ACID OR AMIDE DERIVATIVES, THEIR INDIVIDUAL OPTICAL ISOMERS OR PHARMACEUTICALLY ACCEPTABLE SALTS UCB, S.A. (BE) 2002-10-22 US claimed
US-20010020023-A1 Pharmaceutical compositions for the treatment of rhinitis UCB PHARMA, S.A. (BE) 2001-09-06 US claimed
US-6489329-B2 MIXTURE OF PSEUDOEPHEDRINE AND 2-(4-(DIPHENYLMETHYL)-1-PIPERAZINYL)ACETIC ACID UCB S.A. (BE) 2002-12-03 US disclosed
US-6469009-B1 MIXTURE CONSISTING ESSENTIALLY OF PSEUDOEPHEDRINE AND COMPOUND SELECTED FROM 2-(4-(DIPHENYLMETHYL)-1-PIPERAZINYL)-ACETIC ACID OR AMIDE DERIVATIVES, THEIR INDIVIDUAL OPTICAL ISOMERS OR PHARMACEUTICALLY ACCEPTABLE SALTS UCB, S.A. (BE) 2002-10-22 US disclosed
US-20010020023-A1 Pharmaceutical compositions for the treatment of rhinitis UCB PHARMA, S.A. (BE) 2001-09-06 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-20010020023-A1 Pharmaceutical compositions for the treatment of rhinitis HRH4, HRH2, HRH1 HTR7 45/4885HRH3 4/4885F10 4278/4885

“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.