SCHEMBL25791878

SCHEMBL25791878

CC(C)n1cc(C(F)(F)F)nc1-c1ccc(CO)cc1F

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ USP1 O94782 10/20 0.44
▸ WDR48 Q8TAF3 9/20 0.44
▸ HDAC1 Q13547 7/20 0.36
▸ HDAC6 Q9UBN7 7/20 0.36
▸ HDAC5 Q9UQL6 7/20 0.36
▸ HDAC8 Q9BY41 3/20 0.36
▸ P2RX7 Q99572 1/20 0.35
▸ PTGS2 P35354 1/20 0.34
▸ EGFR P00533 1/20 0.33

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
SCHEMBL31625263 0.89 USP1 (0.41) USP1WDR48PTGS2
SCHEMBL25254428 0.88 USP1 (0.44) USP1WDR48HDAC1HDAC6HDAC5
SCHEMBL22143253 0.88 USP1 (0.44) USP1WDR48HDAC1HDAC6HDAC5
SCHEMBL31293697 0.88 USP1 (0.44) USP1WDR48HDAC1HDAC6HDAC5
SCHEMBL31511354 0.85 USP1 (0.43) USP1WDR48PTGS2
SCHEMBL31254567 0.84 USP1 (0.38) USP1WDR48P2RX7PTGS2
SCHEMBL22143054 0.84 USP1 (0.43) USP1HDAC1HDAC6HDAC5HDAC8
SCHEMBL30320395 0.84 USP1 (0.43) USP1HDAC1HDAC6HDAC5HDAC8
SCHEMBL22143497 0.82 USP1 (0.44) USP1HDAC1HDAC6HDAC5HDAC8
SCHEMBL31138673 0.82 USP1 (0.44) USP1HDAC1HDAC6HDAC5HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024233665-A1 COMPOUNDS AND THEIR USE AGAINST CANCER TANGO THERAPEUTICS, INC. (US) 2024-11-14 — — WO 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
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 USP1 1/4885WDR48 930/4885HDAC1 291/4885

“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.

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