SCHEMBL20306752

SCHEMBL20306752

CC(c1ccccc1)C(C)(C)Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.45
CACNA1F O60840 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
ADRA2B P18089 1/20 0.42
CHRM3 P20309 1/20 0.42
ADRA1A P35348 1/20 0.42
HRH1 P35367 1/20 0.42
OPRK1 P41145 1/20 0.42
CACNA1D Q01668 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KCNH2 Q12809 1/20 0.42
CACNA1S Q13698 1/20 0.42
CACNA1C Q13936 1/20 0.42
SCN5A Q14524 1/20 0.42
SLC6A4 P31645 1/20 0.42
TAAR1 Q96RJ0 4/20 0.41
ADRA2A P08913 1/20 0.39
ADRA2C P18825 1/20 0.39
CYP2D6 P10635 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
SCHEMBL14431333 0.81 TAAR1 (0.50) RIPK1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL18470550 0.81 TAAR1 (0.50) RIPK1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL416895 0.81 TAAR1 (0.50) RIPK1CACNA1FCHRM2CHRM1ADRA2B
Phosphine SCHEMBL9506700 0.80 CYP2D6 (0.41) RIPK1HRH1TAAR1ADRA2AADRA2C
SCHEMBL27962755 0.78 RIPK1 (0.41) RIPK1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL1471159 0.77 SLC6A4 (0.45) RIPK1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL6609543 0.77 RIPK1 (0.43) RIPK1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL30923543 0.77 SLC6A4 (0.45) RIPK1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL12574668 0.77 SLC6A4 (0.45) RIPK1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL11968994 0.77 TAAR1 (0.44) RIPK1CACNA1FCHRM2CHRM1ADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023224240-A1 POLYMER COMPOUND COMPRISING SULFONYL AZIDE GROUP OR SULFONYL FLUORIDE GROUP AT CHAIN END AND PREPARATION METHOD THEREFOR 아주대학교산학협력단 2023-11-23 WO disclosed
US-10005806-B2 Metalporphyrin complex, preparation method therefor and method for preparing polycarbonate CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2018-06-26 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-10005806-B2 Metalporphyrin complex, preparation method therefor and method for preparing polycarbonate CYP4F11, CYP4F12, POR RIPK1 4723/4885CACNA1F 1237/4885CHRM2 2817/4885

“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.