SCHEMBL20552643

SCHEMBL20552643

OCCn1nnc(-c2ccccc2Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 9/20 0.47
▸ ABCB1 P08183 2/20 0.42
▸ DDX3X O00571 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ TAS2R14 Q9NYV8 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MAOB P27338 1/20 0.40

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
SCHEMBL20552347 0.93 ABCG2 (0.46) ABCG2ABCB1DDX3XTAS2R14TP53
SCHEMBL25781534 0.90 ABCG2 (0.39) ABCG2DDX3XTAS2R14TP53ALDH1A1
SCHEMBL20552594 0.90 TAS2R14 (0.55) ABCG2DDX3XTAS2R14ALDH1A1MAPT
SCHEMBL21749269 0.89 ABCG2 (0.46) ABCG2ABCB1DDX3XHDAC6TAS2R14
SCHEMBL20552644 0.88 HDAC6 (0.42) ABCG2DDX3XHDAC6TP53ALDH1A1
SCHEMBL20552265 0.88 ABCG2 (0.45) ABCG2ABCB1DDX3XHDAC6TAS2R14
SCHEMBL20552624 0.88 ABCG2 (0.47) ABCG2ABCB1DDX3XHDAC6TAS2R14
SCHEMBL21749262 0.88 ATM (0.43) LMNASMN1; SMN2MAOB
SCHEMBL20552652 0.88 ALDH1A1 (0.46) TAS2R14ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL21749276 0.87 ABCG2 (0.44) ABCG2ABCB1DDX3XHDAC6TAS2R14

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 ABCG2 3004/4885ABCB1 1774/4885DDX3X 695/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 ABCG2 3004/4885ABCB1 1774/4885DDX3X 695/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 ABCG2 2217/4885ABCB1 1588/4885DDX3X 1986/4885

“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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