SCHEMBL21749294

SCHEMBL21749294

CN(C)CCn1nnc(-c2ccccc2Nc2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.42
▸ SMN1; SMN2 Q16637 6/20 0.42
▸ LMNA P02545 5/20 0.40
▸ USP2 O75604 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ABL1 P00519 1/20 0.39
▸ BCR P11274 1/20 0.39
▸ KMT2A Q03164 6/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ TP53 P04637 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ABCG2 Q9UNQ0 2/20 0.36
▸ DDX3X O00571 1/20 0.36
▸ CHRNA7 P36544 1/20 0.36
▸ HPGD P15428 1/20 0.36

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
SCHEMBL21749274 0.94 MAPT (0.41) MAPTSMN1; SMN2LMNAUSP2L3MBTL1
SCHEMBL25786701 0.92 SMN1; SMN2 (0.41) MAPTSMN1; SMN2LMNAUSP2L3MBTL1
SCHEMBL21749295 0.88 ABCG2 (0.43) MAPTSMN1; SMN2LMNAKMT2ATP53
SCHEMBL20553560 0.87 ABL1 (0.45) MAPTSMN1; SMN2LMNAUSP2L3MBTL1
SCHEMBL25786399 0.86 TSHR (0.49) MAPTSMN1; SMN2LMNAUSP2L3MBTL1
SCHEMBL20552904 0.83 MAPT (0.51) MAPTSMN1; SMN2LMNAUSP2L3MBTL1
SCHEMBL21749296 0.82 DDX3X (0.43) MAPTSMN1; SMN2LMNANPC1RAB9A
SCHEMBL20552758 0.82 ABL1 (0.49) MAPTABL1BCRKMT2AMEN1
SCHEMBL20552398 0.81 MAPT (0.52) MAPTSMN1; SMN2LMNAUSP2L3MBTL1
SCHEMBL20552626 0.80 ABCG2 (0.39) MAPTSMN1; SMN2LMNAUSP2KMT2A

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 MAPT 1705/4885SMN1; SMN2 3160/4885LMNA 2034/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 MAPT 1705/4885SMN1; SMN2 3160/4885LMNA 2034/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 MAPT 516/4885SMN1; SMN2 3035/4885LMNA 2451/4885

“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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