SCHEMBL26674221

SCHEMBL26674221

Cc1cc2c(ccn2CC(C)(C)C)cc1F

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 11/20 0.46
HTR2A P28223 10/20 0.46
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
HTR2B P41595 1/20 0.42
HTR7 P34969 1/20 0.36
GRIN2B Q13224 2/20 0.36
GRM2 Q14416 1/20 0.36
AR P10275 2/20 0.34
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL21872476 0.93 HTR2C (0.46) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL24110247 0.86 HTR2C (0.48) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL18911807 0.83 HTR2A (0.43) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL24144086 0.82 HTR2C (0.45) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL24110357 0.80 HTR2C (0.48) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL26674263 0.80 HTR2C (0.50) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL21872537 0.79 HTR2A (0.40) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL21872603 0.79 HTR2C (0.40) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL24143180 0.79 HTR2C (0.65) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL26674247 0.77 HTR2C (0.41) 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 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 HTR2C 3626/4885HTR2A 3630/4885CYP1A2 479/4885

“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.