SCHEMBL632802

SCHEMBL632802

Fc1c(Cl)cccc1NCc1cnc[nH]1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.57
ADRA1A P35348 5/20 0.55
ADRA1D P25100 1/20 0.55
ADRA1B P35368 1/20 0.55
TAAR1 Q96RJ0 1/20 0.51

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
SCHEMBL4221809 0.85 ADRA2C (0.60) ADRA2CADRA1AADRA1DADRA1BTAAR1
SCHEMBL632163 0.75 ADRA2C (0.58) ADRA2CADRA1AADRA1DADRA1BTAAR1
SCHEMBL2744736 0.75 ADRA1D (0.55) ADRA2CADRA1AADRA1DADRA1BTAAR1
SCHEMBL8212676 0.71 TAAR1 (0.55) TAAR1
SCHEMBL8212500 0.71 MAP3K8 (0.62) TAAR1
SCHEMBL633081 0.70 ADRA2C (0.67) ADRA2CADRA1AADRA1DADRA1BTAAR1
SCHEMBL29450019 0.70 KDM4E (0.69)
SCHEMBL28711239 0.70 KDM4E (0.69)
SCHEMBL8211595 0.69 TAAR1 (0.70) ADRA2CTAAR1
SCHEMBL2626804 0.69 DAO (0.50) ADRA2CADRA1AADRA1DADRA1BTAAR1

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-8586617-B2 Aminomethyl-4-imidazoles HOFFMANN-LA ROCHE INC. (US) 2013-11-19 US disclosed
EP-2076497-B1 AMINOMETHYL-4-IMIDAZOLES HOFFMANN LA ROCHE (CH) 2012-02-22 EP disclosed
EP-2076497-A1 AMINOMETHYL-4-IMIDAZOLES F. Hoffmann-Roche AG (CH) 2009-07-08 EP disclosed
US-20080119535-A1 AMINOMETHYL-4-IMIDAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2008-05-22 US disclosed
WO-2008046757-A1 AMINOMETHYL-4-IMIDAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 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-20080119535-A1 AMINOMETHYL-4-IMIDAZOLES INMT, HTR4, MC4R ADRA2C 275/4885ADRA1A 415/4885ADRA1D 240/4885

“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.