SCHEMBL21749266

SCHEMBL21749266

CC(C)C(=O)Cn1nnc(-c2ccccc2Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ ABCG2 Q9UNQ0 5/20 0.47
▸ MAPT P10636 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ TP53 P04637 1/20 0.46
▸ HPGD P15428 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ ABCB1 P08183 1/20 0.44
▸ USP2 O75604 1/20 0.44

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
SCHEMBL25787264 0.92 SMN1; SMN2 (0.45) LMNAALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL20552875 0.88 ABCG2 (0.53) LMNAALDH1A1ABCG2MAPTSMN1; SMN2
SCHEMBL20553129 0.87 HPGD (0.61) LMNAALDH1A1ABCG2MAPTSMN1; SMN2
SCHEMBL21749252 0.87 TP53 (0.51) LMNAALDH1A1ABCG2MAPTSMN1; SMN2
SCHEMBL20552710 0.87 KDM4E (0.52) LMNAALDH1A1ABCG2MAPTSMN1; SMN2
SCHEMBL20552773 0.86 LMNA (0.47) LMNAALDH1A1ABCG2MAPTSMN1; SMN2
SCHEMBL20552393 0.86 MAPT (0.55) LMNAALDH1A1ABCG2MAPTSMN1; SMN2
SCHEMBL20552675 0.86 TP53 (0.52) LMNAALDH1A1ABCG2MAPTSMN1; SMN2
SCHEMBL20551958 0.85 ABCG2 (0.46) LMNAALDH1A1ABCG2MAPTSMN1; SMN2
SCHEMBL20552430 0.85 ABCG2 (0.44) LMNAALDH1A1ABCG2MAPTSMN1; SMN2

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 LMNA 2034/4885ALDH1A1 3497/4885ABCG2 3004/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 LMNA 2034/4885ALDH1A1 3497/4885ABCG2 3004/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 LMNA 2451/4885ALDH1A1 3323/4885ABCG2 2217/4885

“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.

Send feedback