SCHEMBL26674331

SCHEMBL26674331

CC(C)Cn1ccc2ccc(C(C)C)cc21

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.53
HTR2C P28335 13/20 0.51
HTR2A P28223 11/20 0.51
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
HTR2B P41595 1/20 0.40

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
SCHEMBL25154150 0.81 HTR2C (0.76) HTR7HTR2CHTR2ACYP1A2CYP3A4
SCHEMBL26674340 0.80 HTR7 (0.51) HTR7HTR2CHTR2ACYP1A2CYP3A4
SCHEMBL15712674 0.79 HTR2C (0.55) HTR7HTR2CHTR2ACYP1A2CYP3A4
SCHEMBL24142902 0.79 HTR7 (0.63) HTR7HTR2CHTR2A
SCHEMBL24144837 0.79 HTR2C (0.58) HTR7HTR2CHTR2ACYP1A2CYP3A4
SCHEMBL26673242 0.79 HTR2C (0.77) HTR7HTR2CHTR2ACYP1A2CYP3A4
SCHEMBL25154223 0.79 HTR7 (0.56) HTR7HTR2CHTR2A
SCHEMBL20614497 0.78 HTR1D (0.62) HTR7HTR2CHTR2A
SCHEMBL19553542 0.77 HTR2C (0.53) HTR7HTR2CHTR2ACYP1A2CYP3A4
SCHEMBL24144151 0.77 HTR2C (0.49) HTR7HTR2CHTR2ACYP1A2CYP3A4

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
US-20230339886-A1 REV-ERB AGONISTS FOR THE TREATMENT OF TH17-MEDIATED INFLAMMATORY DISORDERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-10-26 US disclosed
US-20230339886-A1 REV-ERB AGONISTS FOR THE TREATMENT OF TH17-MEDIATED INFLAMMATORY DISORDERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-10-26 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-20230339886-A1 REV-ERB AGONISTS FOR THE TREATMENT OF TH17-MEDIATED INFLAMMATORY DISORDERS NR1H2, NR1H3, NR1D1 HTR7 3434/4885HTR2C 3626/4885HTR2A 3630/4885

“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.