SCHEMBL25829859

SCHEMBL25829859

CC(C)(C)OC(=O)Nc1cc(F)c(Cl)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.41
RXFP1 Q9HBX9 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
KCNQ4 P56696 1/20 0.37
KCNQ5 Q9NR82 1/20 0.37
ATR Q13535 1/20 0.37
BRAF P15056 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
P2RX3 P56373 2/20 0.35
AAK1 Q2M2I8 2/20 0.35
BRD9 Q9H8M2 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
LCK P06239 1/20 0.34
SYK P43405 1/20 0.34

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
SCHEMBL6124200 0.86 CYP17A1 (0.43) CYP17A1RXFP1KCNQ4KCNQ5ATR
SCHEMBL4621173 0.83 CYP17A1 (0.42) CYP17A1RXFP1KCNQ4KCNQ5BRAF
SCHEMBL25863098 0.83 CYP17A1 (0.42) CYP17A1RXFP1KCNQ4KCNQ5BRAF
SCHEMBL31009176 0.82 CYP17A1 (0.44) CYP17A1RXFP1HSP90AA1HSP90AB1KCNQ4
SCHEMBL25829310 0.82 CYP17A1 (0.41) CYP17A1RXFP1KCNQ4KCNQ5BRAF
SCHEMBL25804173 0.82 CYP17A1 (0.44) CYP17A1RXFP1HSP90AA1HSP90AB1KCNQ4
SCHEMBL29021688 0.81 CYP17A1 (0.39) CYP17A1RXFP1HSP90AA1HSP90AB1KCNQ4
SCHEMBL25829763 0.79 CYP17A1 (0.42) CYP17A1RXFP1KCNQ4KCNQ5ATR
SCHEMBL14725520 0.79 CYP17A1 (0.48) CYP17A1RXFP1KCNQ4KCNQ5BRAF
SCHEMBL29021616 0.79 CYP17A1 (0.41) CYP17A1RXFP1KCNQ4KCNQ5BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234922-A1 PROCESSES FOR THE PREPARATION OF 4,6,7-TRIFLUORO-1H-INDOLE-2-CARBOXYLIC ACID ENANTA PHARMACEUTICALS, INC. 2023-07-27 US disclosed
US-20230234922-A1 PROCESSES FOR THE PREPARATION OF 4,6,7-TRIFLUORO-1H-INDOLE-2-CARBOXYLIC ACID ENANTA PHARMACEUTICALS, INC. 2023-07-27 US disclosed
US-20230234922-A1 PROCESSES FOR THE PREPARATION OF 4,6,7-TRIFLUORO-1H-INDOLE-2-CARBOXYLIC ACID ENANTA PHARMACEUTICALS, INC. 2023-07-27 US disclosed
WO-2023137007-A1 PROCESSES FOR THE PREPARATION OF 4,6,7-TRIFLUORO-1H-INDOLE-2-CARBOXYLIC ACID ENANTA PHARMACEUTICALS, INC. (US) 2023-07-20 WO disclosed
WO-2023137007-A1 PROCESSES FOR THE PREPARATION OF 4,6,7-TRIFLUORO-1H-INDOLE-2-CARBOXYLIC ACID ENANTA PHARMACEUTICALS, INC. (US) 2023-07-20 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 (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-20230234922-A1 PROCESSES FOR THE PREPARATION OF 4,6,7-TRIFLUORO-1H-INDOLE-2-CARBOXYLIC ACID ACE2, HTR3C, SARS1 CYP17A1 476/4885RXFP1 3765/4885HSP90AA1 4663/4885

“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.