SCHEMBL25787252

SCHEMBL25787252

FC(F)(F)c1ccc(Nc2ccccc2-c2nnn(CCCP)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 9/20 0.43
▸ DDX3X O00571 1/20 0.43
▸ TAS2R14 Q9NYV8 1/20 0.41
▸ ABCB1 P08183 2/20 0.39
▸ ATM Q13315 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.36
▸ EIF2AK2 P19525 1/20 0.36
▸ KDR P35968 1/20 0.36

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
SCHEMBL21749276 0.90 ABCG2 (0.44) ABCG2DDX3XTAS2R14ABCB1ATM
SCHEMBL20552285 0.89 ABCG2 (0.43) ABCG2DDX3XTAS2R14ABCB1ATM
SCHEMBL20552347 0.89 ABCG2 (0.46) ABCG2DDX3XTAS2R14ABCB1TP53
SCHEMBL25787257 0.89 DDX3X (0.55) ABCG2DDX3XTAS2R14ABCB1MAPT
SCHEMBL21749269 0.87 ABCG2 (0.46) ABCG2DDX3XTAS2R14ABCB1ATM
SCHEMBL20552341 0.87 DDX3X (0.44) ABCG2DDX3XTAS2R14ABCB1ATM
SCHEMBL20552265 0.86 ABCG2 (0.45) ABCG2DDX3XTAS2R14ABCB1ATM
SCHEMBL20552643 0.86 ABCG2 (0.47) ABCG2DDX3XTAS2R14ABCB1TP53
SCHEMBL20552624 0.86 ABCG2 (0.47) ABCG2DDX3XTAS2R14ABCB1ATM
SCHEMBL21749296 0.86 DDX3X (0.43) ABCG2DDX3XTAS2R14ABCB1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-22 — — 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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 ABCG2 2217/4885DDX3X 1986/4885TAS2R14 3753/4885

“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.

Send feedback