SCHEMBL30469084

SCHEMBL30469084

C=CC(=O)NCc1nn(C2CCC(F)(F)CC2)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 1/20 0.46
▸ TEAD4 Q15561 1/20 0.46
▸ TEAD2 Q15562 1/20 0.46
▸ KDM5A P29375 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ KDM5B Q9UGL1 1/20 0.37
▸ KCNJ6 P48051 1/20 0.36
▸ KCNJ5 P48544 1/20 0.36
▸ KCNJ3 P48549 1/20 0.36
▸ NUDT14 O95848 1/20 0.36
▸ NUDT5 Q9UKK9 1/20 0.36
▸ MAPK3 P27361 1/20 0.35
▸ BTK Q06187 2/20 0.34
▸ TGM2 P21980 3/20 0.34
▸ CHRNA7 P36544 1/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ PARP2 Q9UGN5 1/20 0.34
▸ SSTR4 P31391 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ SCN5A Q14524 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
SCHEMBL25234036 1.00 TEAD1 (0.46) TEAD1TEAD4TEAD2KDM5AKDM4C
SCHEMBL25236489 0.87 TEAD1 (0.52) TEAD1TEAD4TEAD2KDM5AKDM4C
SCHEMBL30469098 0.81 TEAD1 (0.46) TEAD1TEAD4TEAD2KDM5AKDM4C
SCHEMBL25678135 0.81 TEAD1 (0.46) TEAD1TEAD4TEAD2KDM5AKDM4C
SCHEMBL25678129 0.76 TEAD1 (0.53) TEAD1TEAD4TEAD2KDM5AKDM4C
Trifluoroacetic Acid SCHEMBL25278948 0.75 TEAD1 (0.51) TEAD1TEAD4TEAD2KDM5AKDM4C
SCHEMBL25747717 0.74 HSD17B13 (0.43) TGM2SSTR4
SCHEMBL25747719 0.72 RARG (0.45) TGM2SCN9A
SCHEMBL31214667 0.69 CNR2 (0.39) MAPK3TGM2CHRNA7SSTR4
SCHEMBL25234811 0.69 TEAD1 (0.42) TEAD1TEAD4TEAD2KDM5AKDM4C

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
EP-4452936-A2 INDOLES, INDAZOLES, AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD The Katholieke Universiteit Leuven (BE) 2024-10-30 — — EP disclosed
WO-2023122782-A2 INDOLES, INDAZOLES, AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-06-29 — — WO disclosed
US-20230202985-A1 Indoles, Indazoles, and Related Analogs for Inhibiting YAP/TAZ-TEAD CISTIM LEUVEN VZW (BE) 2023-06-29 — — 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-20230202985-A1 Indoles, Indazoles, and Related Analogs for Inhibiting YAP/TAZ-TEAD YAP1, TEAD2, TEAD3 TEAD1 4/4885TEAD4 5/4885TEAD2 2/4885

“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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