SCHEMBL10241538

SCHEMBL10241538

O=CC1(c2ccccc2)CC1CO

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.37
MAOB P27338 7/20 0.36
HTR2C P28335 3/20 0.36
HTR2A P28223 2/20 0.36
HTR2B P41595 2/20 0.36
SLC6A2 P23975 7/20 0.36
LMNA P02545 1/20 0.36
SLC6A4 P31645 5/20 0.35
SLC6A3 Q01959 3/20 0.35
CYP2D6 P10635 1/20 0.35
MAOA P21397 3/20 0.34
GAA P10253 2/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL2610462 0.90 LMNA (0.35) PTGS2MAOBHTR2CHTR2AHTR2B
SCHEMBL10188806 0.81 PTGS2 (0.35) PTGS2MAOBHTR2CHTR2AHTR2B
SCHEMBL9951558 0.77 HTR2A (0.35) PTGS2MAOBHTR2CHTR2AHTR2B
SCHEMBL9951554 0.77 HTR2A (0.35) PTGS2MAOBHTR2CHTR2AHTR2B
SCHEMBL13720499 0.76 TSHR (0.40) LMNACYP2D6
SCHEMBL4022057 0.76 TSHR (0.40) LMNACYP2D6
SCHEMBL13045928 0.75 KCNH2 (0.39) MAOBMAOA
SCHEMBL20747663 0.72 PTGS2 (0.41) PTGS2MAOBHTR2CHTR2AHTR2B
SCHEMBL21834929 0.72 PTGS2 (0.41) PTGS2MAOBHTR2CHTR2AHTR2B
SCHEMBL16638921 0.72 SLC6A2 (0.31) SLC6A2

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-20120165339-A1 CYCLOPROPANE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-06-28 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-20120165339-A1 CYCLOPROPANE DERIVATIVES HCRTR2, HCRTR1, CNR1 PTGS2 1465/4885MAOB 546/4885HTR2C 152/4885

“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.