SCHEMBL21749247

SCHEMBL21749247

FC(F)(F)c1ccc(Nc2ccccc2-c2nnn(Cc3cccnc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 6/20 0.45
▸ EPAS1 Q99814 6/20 0.45
▸ PLK1 P53350 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ ABCG2 Q9UNQ0 2/20 0.40
▸ NR3C1 P04150 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ P2RX7 Q99572 3/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TAS2R14 Q9NYV8 1/20 0.38
▸ GRIN1 Q05586 1/20 0.37
▸ GRIN2B Q13224 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
SCHEMBL25786602 0.92 CYP3A4 (0.40) HIF1AEPAS1PLK1HDAC6ABCG2
SCHEMBL25787689 0.92 HIF1A (0.38) HIF1AEPAS1PLK1HDAC6ABCG2
SCHEMBL25787692 0.91 CYP3A4 (0.39) HIF1AEPAS1PLK1HDAC6ABCG2
SCHEMBL21749297 0.90 HDAC6 (0.47) HIF1AEPAS1HDAC6ABCG2TP53
SCHEMBL21749265 0.87 ABL1 (0.50) CYP3A4CYP2C19RAB9AL3MBTL1
SCHEMBL25786607 0.83 HDAC6 (0.41) HDAC6ABCG2CYP3A4CYP2C19RAB9A
SCHEMBL21749248 0.83 USP2 (0.48) PLK1ABCG2CYP3A4CYP2C19RAB9A
SCHEMBL25787424 0.82 TP53 (0.49) HDAC6ABCG2TP53TAS2R14
SCHEMBL20552643 0.82 ABCG2 (0.47) HDAC6ABCG2TP53TAS2R14
SCHEMBL20552624 0.82 ABCG2 (0.47) HDAC6ABCG2TP53TAS2R14

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 6 patents. 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
US-11186554-B2 Non-fused tricyclic compounds VIVACE THERAPEUTICS, INC. (US) 2021-11-30 — — US disclosed
US-11186554-B2 Non-fused tricyclic compounds VIVACE THERAPEUTICS, INC. (US) 2021-11-30 — — US disclosed
CN-111132673-A Non-fused tricyclic compounds 维瓦斯治疗公司 2020-05-08 — — CN disclosed
US-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-02-27 — — US disclosed
US-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-02-27 — — 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 (3 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-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS YAP1, MYC, TEAD2 HIF1A 1235/4885EPAS1 217/4885PLK1 33/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 HIF1A 1235/4885EPAS1 217/4885PLK1 33/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 HIF1A 971/4885EPAS1 83/4885PLK1 2046/4885

“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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