SCHEMBL25787244

SCHEMBL25787244

CC(C)n1nnc(-c2ccccc2Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 11/20 0.46
▸ ABCB1 P08183 2/20 0.43
▸ TAS2R14 Q9NYV8 2/20 0.43
▸ KCNH3 Q9ULD8 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CTDSP1 Q9GZU7 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ BRAF P15056 1/20 0.39
▸ KCNK18 Q7Z418 1/20 0.37

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
SCHEMBL25787897 0.91 ABCG2 (0.38) ABCG2ABCB1TAS2R14RAB9AKCNK18
SCHEMBL20552442 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1
SCHEMBL21764769 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1
SCHEMBL21765038 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1
SCHEMBL21764732 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1
SCHEMBL20552505 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1
SCHEMBL20553162 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1
SCHEMBL20552770 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1
SCHEMBL20552443 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1
SCHEMBL21765056 0.89 ABCG2 (0.45) ABCG2ABCB1TAS2R14KCNH3MEN1

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 2217/4885ABCB1 1588/4885TAS2R14 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.

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