SCHEMBL20747663

SCHEMBL20747663

OC[C@@H]1CC1(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.41
MAOB P27338 10/20 0.40
HTR2A P28223 3/20 0.40
HTR2C P28335 3/20 0.40
HTR2B P41595 3/20 0.40
LMNA P02545 1/20 0.39
MAOA P21397 3/20 0.39
GAA P10253 1/20 0.38
KDM1A O60341 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL21834929 1.00 PTGS2 (0.41) PTGS2MAOBHTR2AHTR2CHTR2B
SCHEMBL6264514 0.83 MAOB (0.40) MAOBHTR2AHTR2CHTR2BLMNA
SCHEMBL9541908 0.78 MAOB (0.58) MAOBHTR2AHTR2CHTR2BMAOA
SCHEMBL9950472 0.75 OPRK1 (0.55) PTGS2MAOBHTR2AHTR2CHTR2B
SCHEMBL11086077 0.75 OPRK1 (0.55) PTGS2MAOBHTR2AHTR2CHTR2B
SCHEMBL6445552 0.75 MAOB (0.65) MAOBHTR2AHTR2CHTR2BMAOA
SCHEMBL2119239 0.75 OPRK1 (0.55) PTGS2MAOBHTR2AHTR2CHTR2B
SCHEMBL22504105 0.75 SLC6A2 (0.41) MAOBHTR2AHTR2CHTR2BLMNA
SCHEMBL10468078 0.75 LMNA (0.41) MAOBHTR2CLMNAALDH1A1
SCHEMBL10468077 0.75 LMNA (0.41) MAOBHTR2CLMNAALDH1A1

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
EP-3858816-A1 NOVEL METHOD FOR PREPARING (-)-CIBENZOLINE SUCCINATE Celltrion, Inc. (KR) 2021-08-04 EP disclosed
US-10208045-B2 Aza-pyridone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2019-02-19 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-10208045-B2 Aza-pyridone compounds and uses thereof PNPO, ITPA, PDXK PTGS2 4151/4885MAOB 166/4885HTR2A 2492/4885

“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.