SCHEMBL23910646

SCHEMBL23910646

CC1(C(=O)O)Cc2cc(Cl)cc(Br)c2O1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 9/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
MCL1 Q07820 1/20 0.34
HTR2A P28223 1/20 0.34
PPARA Q07869 1/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.32
AKR1B1 P15121 1/20 0.32

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
SCHEMBL1005341 0.78 HTR2A (0.51) FFAR4HTR2ASIRT2
SCHEMBL27843492 0.77 PTGS2 (0.38) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL19469461 0.73 PPARA (0.48) MCL1PPARAAKR1B1
SCHEMBL29495503 0.73 PPARA (0.48) MCL1PPARAAKR1B1
SCHEMBL19469463 0.73 PPARA (0.48) MCL1PPARAAKR1B1
SCHEMBL19469478 0.73 PPARA (0.48) MCL1PPARAAKR1B1
SCHEMBL29495290 0.73 PPARA (0.48) MCL1PPARAAKR1B1
SCHEMBL2466348 0.70 HTR2A (0.32) HTR2A
SCHEMBL19030472 0.70 AKR1B1 (0.42) PPARAAKR1B1
SCHEMBL9518673 0.69 ALDH1A1 (0.35) HTR2ASIRT2

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-20210317134-A1 UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 7 (USP7) MODULATORS AND USES THEREOF RAPT THERAPEUTICS INC (US) 2021-10-14 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-20210317134-A1 UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 7 (USP7) MODULATORS AND USES THEREOF USP7, SENP7, USP8 FFAR4 4584/4885PTGS1 3404/4885PTGS2 3612/4885

“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.