SCHEMBL21958136

SCHEMBL21958136

C=CC(=O)N1CC[C@H](OCc2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 14/20 0.63
LIPG Q9Y5X9 2/20 0.52
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
MMP2 P08253 1/20 0.48
MMP13 P45452 1/20 0.48
NAAA Q02083 1/20 0.46
EGFR P00533 1/20 0.45

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
SCHEMBL27398364 1.00 TEAD1 (0.63) TEAD1LIPGCARM1PRMT6MMP2
SCHEMBL27399262 0.93 TEAD1 (0.65) TEAD1LIPGCARM1PRMT6MMP2
SCHEMBL27400014 0.90 LIPG (0.52) TEAD1LIPGCARM1PRMT6MMP2
SCHEMBL27398290 0.90 LIPG (0.52) TEAD1LIPGCARM1PRMT6MMP2
SCHEMBL27398844 0.88 TEAD1 (0.60) TEAD1LIPGEGFR
SCHEMBL27398968 0.88 TEAD1 (0.60) TEAD1LIPGEGFR
SCHEMBL27399385 0.87 LIPG (0.49) TEAD1LIPGCARM1PRMT6MMP2
SCHEMBL27398302 0.87 LIPG (0.49) TEAD1LIPGCARM1PRMT6MMP2
SCHEMBL27399389 0.87 LIPG (0.49) TEAD1LIPGCARM1PRMT6MMP2
SCHEMBL27398796 0.87 LIPG (0.49) TEAD1LIPGCARM1PRMT6MMP2

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
WO-2024091511-A1 HETEROCYCLIC TEAD INHIBITORS LIGHT HORSE THERAPEUTICS, INC. (US) 2024-05-02 WO disclosed
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
WO-2020081572-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-04-23 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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 TEAD1 1/4885LIPG 3706/4885CARM1 1732/4885

“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.