SCHEMBL20553472

SCHEMBL20553472

NC(=O)OCCn1nnc(-c2ccccc2Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 9/20 0.46
▸ ABCB1 P08183 2/20 0.44
▸ MAPT P10636 5/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ DDX3X O00571 1/20 0.42
▸ KDM4E B2RXH2 4/20 0.41
▸ TP53 P04637 3/20 0.41
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ LMNA P02545 2/20 0.40
▸ HTT P42858 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
SCHEMBL20552388 0.94 ABCG2 (0.45) ABCG2ABCB1MAPTSMN1; SMN2DDX3X
SCHEMBL20552909 0.87 ABCG2 (0.43) ABCG2ABCB1MAPTSMN1; SMN2DDX3X
SCHEMBL20552710 0.86 KDM4E (0.52) ABCG2ABCB1MAPTSMN1; SMN2KDM4E
SCHEMBL25787077 0.85 ABCG2 (0.42) ABCG2ABCB1MAPTSMN1; SMN2DDX3X
SCHEMBL20552267 0.85 ABCG2 (0.47) ABCG2ABCB1MAPTSMN1; SMN2DDX3X
SCHEMBL21749240 0.85 ABCG2 (0.43) ABCG2ABCB1MAPTSMN1; SMN2DDX3X
SCHEMBL20552459 0.85 ABCG2 (0.47) ABCG2ABCB1MAPTSMN1; SMN2DDX3X
SCHEMBL20552643 0.83 ABCG2 (0.47) ABCG2ABCB1MAPTSMN1; SMN2DDX3X
SCHEMBL20552265 0.83 ABCG2 (0.45) ABCG2ABCB1MAPTSMN1; SMN2DDX3X
SCHEMBL20552901 0.83 ABCG2 (0.41) ABCG2ABCB1MAPTSMN1; SMN2DDX3X

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-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
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 1774/4885MAPT 1705/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 ABCG2 3004/4885ABCB1 1774/4885MAPT 1705/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 ABCG2 2217/4885ABCB1 1588/4885MAPT 516/4885

“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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