SCHEMBL25792585

SCHEMBL25792585

CCn1cc(C(F)(F)F)nc1-c1ccc(CC(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.46
RXRB P28702 10/20 0.46
RXRG P48443 9/20 0.46
CYP2C9 P11712 1/20 0.46
PTGS2 P35354 2/20 0.45
USP1 O94782 2/20 0.43
DGAT1 O75907 2/20 0.42
SYK P43405 1/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL24718540 0.85 RXRA (0.49) RXRARXRBRXRGCYP2C9PTGS2
SCHEMBL22143303 0.83 USP1 (0.46) PTGS2USP1DGAT1
SCHEMBL30320382 0.81 DGAT1 (0.49) PTGS2USP1DGAT1
SCHEMBL30320428 0.81 USP1 (0.45) PTGS2USP1DGAT1
SCHEMBL25975798 0.81 USP1 (0.46) PTGS2USP1DGAT1
SCHEMBL25791868 0.81 USP1 (0.46) PTGS2USP1DGAT1
SCHEMBL25466455 0.81 USP1 (0.51) PTGS2USP1DGAT1
SCHEMBL25792141 0.80 DGAT1 (0.43) PTGS2USP1DGAT1
SCHEMBL11622203 0.80 PTGS2 (0.51) PTGS2USP1DGAT1
SCHEMBL25181306 0.78 USP1 (0.45) PTGS2USP1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219965-A1 NITROGEN-CONTAINING FUSED BICYCLIC COMPOUNDS AND THEIR USE AS UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 1 (USP1) INHIBITORS KSQ Therapeutics, Inc. 2023-07-13 US disclosed
US-20230219965-A1 NITROGEN-CONTAINING FUSED BICYCLIC COMPOUNDS AND THEIR USE AS UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 1 (USP1) INHIBITORS KSQ Therapeutics, Inc. 2023-07-13 US disclosed
EP-4161494-A1 NITROGEN-CONTAINING FUSED BICYCLIC COMPOUNDS AND THEIR USE AS UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 1 (USP1) INHIBITORS KSQ Therapeutics, Inc. (US) 2023-04-12 EP 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-20230219965-A1 NITROGEN-CONTAINING FUSED BICYCLIC COMPOUNDS AND THEIR USE AS UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 1 (USP1) INHIBITORS USP1, USP8, USP7 RXRA 1951/4885RXRB 1756/4885RXRG 1792/4885

“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.