SCHEMBL27112644

SCHEMBL27112644

CCn1cc(C)c2cc(C(C)C)ccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
RORA P35398 1/20 0.39
RORC P51449 1/20 0.39
RORB Q92753 1/20 0.39
TRPA1 O75762 1/20 0.38
PTGS1 P23219 1/20 0.38
CACNA1C Q13936 1/20 0.38
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
HTR6 P50406 1/20 0.34
CYP19A1 P11511 5/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL15701668 0.82 RORA (0.38) RORARORCRORBCNR1CNR2
SCHEMBL15701664 0.82 RORA (0.41) LMNARORARORCRORBCNR1
SCHEMBL15701667 0.82 RORA (0.38) LMNARORARORCRORBCNR1
SCHEMBL11075326 0.79 CACNB4 (0.39) LMNARORARORCRORBCACNA1C
SCHEMBL24824798 0.76 CYP19A1 (0.44) CNR1CNR2HTR6CYP19A1KDM4E
SCHEMBL16727205 0.76 PTGER4 (0.43) LMNACYP19A1CYP2C19KDM4EALDH1A1
SCHEMBL16727207 0.74 ACSS2 (0.36) LMNATHRATHRBCNR2HTR6
SCHEMBL16729368 0.73 PDE4A (0.46) RORARORCRORBHTR6MAP3K5
SCHEMBL13084772 0.73 RORC (0.54) LMNARORARORCRORBKDM4E
SCHEMBL11628385 0.72 PTGER4 (0.50) LMNAHTR6KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066027-A1 NOVEL PAR-2 INHIBITORS DOMAIN THERAPEUTICS (FR) 2024-02-29 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-20240066027-A1 NOVEL PAR-2 INHIBITORS F2RL1, F2R, F2RL3 LMNA 1935/4885RORA 4220/4885RORC 3607/4885

“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.