SCHEMBL6748800

SCHEMBL6748800

C[C@H](N)Cc1n[nH]c2ccc3c(c12)CCCO3

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 10/20 0.62
HTR2B P41595 8/20 0.62
HTR2A P28223 8/20 0.62
HTR1A P08908 6/20 0.62
HTR1D P28221 5/20 0.62
HTR6 P50406 2/20 0.62
HTR4 Q13639 2/20 0.62
ADRA2A P08913 1/20 0.62
ADRA2C P18825 1/20 0.62
HTR1B P28222 1/20 0.62
HTR7 P34969 1/20 0.62
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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 SCHEMBL6751698 0.99 HTR2C (0.61) HTR2CHTR2BHTR2AHTR1AHTR1D
SCHEMBL6205030 0.78 HTR2C (0.50) HTR2CHTR2BHTR2AHTR1AHTR1D
SCHEMBL5784125 0.78 HTR2C (0.38) HTR2CHTR2BHTR2AHTR1AHTR1D
SCHEMBL5784122 0.78 HTR2C (0.38) HTR2CHTR2BHTR2AHTR1AHTR1D
SCHEMBL5781742 0.78 HTR2C (0.38) HTR2CHTR2BHTR2AHTR1AHTR1D
Hydrochloric Acid SCHEMBL6202353 0.77 HTR2C (0.49) HTR2CHTR2BHTR2AHTR1AHTR1D
SCHEMBL5936562 0.77 HTR2C (1.00) HTR2CHTR2BHTR2AHTR1AHTR1D
SCHEMBL6092065 0.77 HTR2C (1.00) HTR2CHTR2BHTR2AHTR1AHTR1D
SCHEMBL30390274 0.77 HTR2C (1.00) HTR2CHTR2BHTR2AHTR1AHTR1D
SCHEMBL6094978 0.77 HTR2C (1.00) HTR2CHTR2BHTR2AHTR1AHTR1D

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-6696476-B2 SUCH AS 1-(2-AMINOPROPYL)-1,7,8,9-TETRAHYDRO-PYRANO(2,3-G)-INDAZOL-8-OL; LOWERING AND CONTROLLING INTRAOCULAR PRESSURE ALCON, INC. (CH) 2004-02-24 US claimed
US-20030171418-A1 Reducing or controlling eye pressure NOVARTIS AG (CH) 2003-09-11 US claimed
US-6696476-B2 SUCH AS 1-(2-AMINOPROPYL)-1,7,8,9-TETRAHYDRO-PYRANO(2,3-G)-INDAZOL-8-OL; LOWERING AND CONTROLLING INTRAOCULAR PRESSURE ALCON, INC. (CH) 2004-02-24 US disclosed
US-20030171418-A1 Reducing or controlling eye pressure NOVARTIS AG (CH) 2003-09-11 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-20030171418-A1 Reducing or controlling eye pressure PDE3A, PDE3B, QDPR HTR2C 1978/4885HTR2B 1919/4885HTR2A 1849/4885

“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.