SCHEMBL7092716

SCHEMBL7092716

CC(N)Cn1ccc2cc(Cl)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 19/20 1.00
HTR2A P28223 17/20 1.00
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C9 P11712 1/20 0.62
HTR2B P41595 1/20 0.62
PRMT5 O14744 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
SCHEMBL9232780 1.00 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL8959591 1.00 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
Fumaric Acid SCHEMBL7091387 0.88 HTR2C (0.78) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
Fumaric Acid SCHEMBL7091385 0.88 HTR2C (0.78) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL7997689 0.87 HTR2C (0.77) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL4033420 0.87 HTR2C (0.77) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL8959778 0.84 HTR2C (0.72) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL8959781 0.84 HTR2C (0.72) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL9233993 0.82 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL9233990 0.82 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030114512-A1 Compounds with 5-ht2 and 5-ht1a agonist activity for treating glaucoma ALCON UNIVERSAL LTD. (CH) 2003-06-19 US claimed
EP-1263434-A1 COMPOUNDS WITH 5-HT 2 AND 5-HT 1A AGONIST ACTIVITY FOR TREATING GLAUCOMA Alcon, Inc (CH) 2002-12-11 EP claimed
WO-2001070223-A1 COMPOUNDS WITH 5-HT2 AND 5-HT1A AGONIST ACTIVITY FOR TREATING GLAUCOMA ALCON, INC. (CH) 2001-09-27 WO claimed
CN-1061341-C 1-amino-ethylindole-derivatives HOFFMANN LA ROCHE (CH) 2001-01-31 CN claimed
CN-1105988-A 1-amino-ethylindole-derivatives HOFFMANN LA ROCHE (CH) 1995-08-02 CN claimed
EP-0655440-A2 1-Aminoethylindoles F. HOFFMANN-LA ROCHE AG (CH) 1995-05-31 EP claimed
CN-1061341-C 1-amino-ethylindole-derivatives HOFFMANN LA ROCHE (CH) 2001-01-31 CN disclosed
US-5494928-A FOR CENTRAL NERVOUS SYSTEM DISORDERS, BLOCKING SEROTONIN RECEPTORS, ANTIDEPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1996-02-27 US disclosed
CN-1105988-A 1-amino-ethylindole-derivatives HOFFMANN LA ROCHE (CH) 1995-08-02 CN disclosed
EP-0655440-A2 1-Aminoethylindoles F. HOFFMANN-LA ROCHE AG (CH) 1995-05-31 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 (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-20030114512-A1 Compounds with 5-ht2 and 5-ht1a agonist activity for treating glaucoma HTR1A, HTR2A, HTR5A HTR2C 6/4885HTR2A 2/4885CYP1A2 478/4885

“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.