SCHEMBL4775873

SCHEMBL4775873

c1csc(CCc2ncc[nH]2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 8/20 0.44
TERT O14746 1/20 0.41
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
ADRA1D P25100 1/20 0.39
HRH4 Q9H3N8 1/20 0.39

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
SCHEMBL954267 0.84 TAAR1 (0.53) TAAR1TSHRLMNAADRA1D
SCHEMBL285224 0.77 TERT (0.59) TAAR1TERTTSHRCYP2D6
SCHEMBL2030841 0.74 TAAR1 (0.71) TAAR1TSHR
SCHEMBL5548987 0.71 TERT (0.43) TAAR1TERTCYP2D6
SCHEMBL5757254 0.71 MGMT (0.39) TAAR1TSHRLMNACYP2D6ADRA1D
SCHEMBL570036 0.71 TAAR1 (0.69) TAAR1TERTTSHRLMNACYP2D6
SCHEMBL8112129 0.70 ADRA1D (0.37) TAAR1TSHRLMNACYP2D6ADRA1D
Hydrochloric Acid SCHEMBL1846181 0.69 TAAR1 (0.67) TAAR1TERTTSHRLMNACYP2D6
SCHEMBL3529630 0.69 TAAR1 (0.44) TAAR1TSHRLMNAADRA1D
SCHEMBL10364897 0.69 TAAR1 (0.44) TAAR1TERTTSHRLMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120328628-A1 ANTIBODIES TO CONFORMATIONALLY TRAPPED PROTEINS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-12-27 US disclosed
WO-2008006087-A2 ANTIBODIES TO CONFORMATIONALLY TRAPPED PROTEINS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-01-10 WO disclosed
US-6048878-A Substituted piperidine derivatives as selective agonists of 5-HT receptors MERCK SHARP & DOHME LTD. (GB) 2000-04-11 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-20120328628-A1 ANTIBODIES TO CONFORMATIONALLY TRAPPED PROTEINS TRAP1, UACA, SSB TAAR1 4727/4885TERT 3855/4885TSHR 2984/4885

“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.