SCHEMBL7797212

SCHEMBL7797212

Cc1cc(C)c2c(c1C)OC(C)(CC(=O)O)CC2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.43
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
PSEN1 P49768 5/20 0.39
NR1I2 O75469 1/20 0.38
PTPN1 P18031 1/20 0.37
GSTO1 P78417 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
SCHEMBL4779257 0.86 ALOX5 (0.51) ALOX5PSEN1NR1I2PTPN1GSTO1
SCHEMBL8712759 0.86 ALOX5 (0.33) ALOX5PTGS1PTGS2CYP1A2CYP3A4
SCHEMBL7795197 0.83 ALOX5 (0.39) ALOX5NR1I2
SCHEMBL20819448 0.82 ALOX5 (0.41) ALOX5CYP3A4TSHRNR1I2
SCHEMBL20819447 0.82 ALOX5 (0.41) ALOX5CYP3A4TSHRNR1I2
SCHEMBL7501769 0.82 ALOX5 (0.38) ALOX5PTGS1PTGS2CYP3A4TSHR
SCHEMBL7799047 0.81 PSEN1 (0.45) ALOX5PSEN1NR1I2PTPN1GSTO1
SCHEMBL16282031 0.81 ALOX5 (0.37) ALOX5CYP3A4TSHRNR1I2
Propionic Acid SCHEMBL5484943 0.81 PTGS1 (0.39) ALOX5PTGS1PTGS2CYP1A2CYP3A4
SCHEMBL20822167 0.80 PTPN1 (0.45) ALOX5PSEN1NR1I2PTPN1GSTO1

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-20010012901-A1 Sulphonyl compounds for use as linkers in solid phase and combinatorial synthesis FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2001-08-09 US disclosed
US-6225480-B1 FOR SYNTHESIS OF ORGANIC COMPOUNDS CONTAINING--NH--GROUPS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-01 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-20010012901-A1 Sulphonyl compounds for use as linkers in solid phase and combinatorial synthesis H1-0, H1-2, ASH2L ALOX5 2905/4885PTGS1 914/4885PTGS2 1068/4885

“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.