SCHEMBL20552275

SCHEMBL20552275

O=C(O)Cn1nnc(-c2ccccc2Nc2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ YAP1 P46937 1/20 0.47
▸ TEAD4 Q15561 1/20 0.47
▸ TEAD2 Q15562 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ POLB P06746 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ RXFP1 Q9HBX9 2/20 0.47
▸ MAPT P10636 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ ABCG2 Q9UNQ0 1/20 0.45
▸ MPO P05164 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ XPO1 O14980 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
SCHEMBL20552262 0.91 KDM4E (0.52) YAP1TEAD4TEAD2ALDH1A1POLB
SCHEMBL20552875 0.89 ABCG2 (0.53) ALDH1A1POLBHTTMAPTKDM4E
SCHEMBL20552256 0.87 XPO1 (0.54) ALDH1A1MAPTMEN1KMT2ATP53
SCHEMBL20552652 0.86 ALDH1A1 (0.46) YAP1TEAD4TEAD2ALDH1A1RXFP1
SCHEMBL20552892 0.84 ALDH1A1 (0.44) YAP1TEAD4TEAD2ALDH1A1RXFP1
SCHEMBL20552415 0.84 YAP1 (0.47) YAP1TEAD4TEAD2RXFP1ABCG2
SCHEMBL21749307 0.84 MAPT (0.49) YAP1TEAD4TEAD2ALDH1A1RXFP1
SCHEMBL21764708 0.82 ALDH1A1 (0.44) YAP1TEAD4TEAD2ALDH1A1RXFP1
SCHEMBL20553158 0.82 XPO1 (0.49) YAP1TEAD4TEAD2ALDH1A1MAPT
SCHEMBL21749242 0.82 TP53 (0.44) ALDH1A1RXFP1MAPTTP53LMNA

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 YAP1 1/4885TEAD4 7/4885TEAD2 3/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 YAP1 1/4885TEAD4 7/4885TEAD2 3/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 YAP1 9/4885TEAD4 2/4885TEAD2 3/4885

“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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