SCHEMBL25835552

SCHEMBL25835552

CC(C)(C)OC(=O)NCc1cnc(-c2ccc(F)cc2)cc1-c1ccnn1C1CCCCO1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATR Q13535 10/20 0.44
CYP4F2 P78329 6/20 0.43
CYP4A11 Q02928 6/20 0.43
GRM2 Q14416 1/20 0.36
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35

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
SCHEMBL25303095 0.81 CYP4F2 (0.44) ATRCYP4F2CYP4A11RXRARXRB
SCHEMBL25297191 0.80 CYP4F2 (0.48) ATRCYP4F2CYP4A11RXRARXRB
SCHEMBL31129946 0.79 ATR (0.47) ATRCYP4F2CYP4A11RXRARXRB
SCHEMBL25837090 0.74 GRM2 (0.42) GRM2ACACBACACA
SCHEMBL30510044 0.74 GRM2 (0.42) GRM2ACACBACACA
SCHEMBL25262023 0.74 CYP4F2 (0.50) ATRCYP4F2CYP4A11
SCHEMBL30509961 0.74 CYP4F2 (0.50) ATRCYP4F2CYP4A11
SCHEMBL25378588 0.74 CYP4F2 (0.42) ATRCYP4F2CYP4A11RXRARXRB
SCHEMBL30509985 0.73 NTRK1 (0.46) ATRGRM2ACACBACACA
SCHEMBL25837946 0.73 NTRK1 (0.46) ATRGRM2ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4452253-A2 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD The Katholieke Universiteit Leuven (BE) 2024-10-30 EP disclosed
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2024-07-09 US disclosed
WO-2023122780-A9 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
WO-2023122780-A9 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
US-20230278982-A1 2-Pyrazole Anilines and Related Analogs for Inhibiting YAP/TAZ-TEAD KU LEUVEN R&D (BE) 2023-09-07 US disclosed
WO-2023122780-A2 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-06-29 WO disclosed
WO-2023122780-A2 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-06-29 WO 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 (2 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-20230278982-A1 2-Pyrazole Anilines and Related Analogs for Inhibiting YAP/TAZ-TEAD YAP1, TEAD3, TEAD2 ATR 1391/4885CYP4F2 2364/4885CYP4A11 2746/4885
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD YAP1, TEAD3, TEAD2 ATR 1391/4885CYP4F2 2364/4885CYP4A11 2746/4885

“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.