SCHEMBL20553196

SCHEMBL20553196

CCOC(=O)Cn1cc(-c2ccccc2Nc2cccc(C(F)(F)F)c2)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN1 Q05586 2/20 0.45
▸ GRIN2B Q13224 2/20 0.45
▸ KDR P35968 1/20 0.44
▸ CACNA1B Q00975 1/20 0.44
▸ APBA1 Q02410 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ YAP1 P46937 1/20 0.43
▸ TEAD4 Q15561 1/20 0.43
▸ TEAD2 Q15562 1/20 0.43
▸ FGFR1 P11362 4/20 0.43
▸ DDR2 Q16832 4/20 0.43
▸ LMNA P02545 2/20 0.43
▸ RECQL P46063 1/20 0.43
▸ BRAF P15056 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ TRPV4 Q9HBA0 1/20 0.42
▸ PDK2 Q15119 1/20 0.42

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
SCHEMBL20552657 0.90 JAK1 (0.43) PDK2JAK2JAK1
SCHEMBL20551821 0.87 PDK2 (0.52) KDRYAP1TEAD4TEAD2FGFR1
SCHEMBL21749293 0.84 CACNA1B (0.44) GRIN1GRIN2BCACNA1BAPBA1NPSR1
SCHEMBL20552312 0.84 CACNA1B (0.47) GRIN1GRIN2BCACNA1BAPBA1NPSR1
SCHEMBL21765002 0.83 ALDH1A1 (0.42) YAP1TEAD4TEAD2FGFR1DDR2
SCHEMBL20553653 0.83 YAP1 (0.46) GRIN1GRIN2BCACNA1BAPBA1NPSR1
SCHEMBL21749289 0.82 PDK2 (0.50) YAP1TEAD4TEAD2FGFR1DDR2
SCHEMBL20552256 0.80 XPO1 (0.54) CACNA1BAPBA1NPSR1LMNA
SCHEMBL20553072 0.78 LMNA (0.45) GRIN1GRIN2BCACNA1BAPBA1NPSR1
SCHEMBL25786437 0.78 IRAK4 (0.43) GRIN1GRIN2BCACNA1BAPBA1NPSR1

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 8 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
EP-3618818-A1 NON-FUSED TRICYCLIC COMPOUNDS Vivace Therapeutics, Inc. (US) 2020-03-11 — — EP 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
WO-2018204532-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2018-11-08 — — 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 (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 GRIN1 2911/4885GRIN2B 3641/4885KDR 1806/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 GRIN1 2911/4885GRIN2B 3641/4885KDR 1806/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 GRIN1 3985/4885GRIN2B 3672/4885KDR 4727/4885

“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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