SCHEMBL21749304

SCHEMBL21749304

FC(F)(F)c1ccc(Nc2ccccc2-c2nnn(Cc3ccccn3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ABCG2 Q9UNQ0 7/20 0.41
▸ NR3C1 P04150 2/20 0.41
▸ HDAC6 Q9UBN7 2/20 0.39
▸ TAS2R14 Q9NYV8 1/20 0.39
▸ ABCB1 P08183 1/20 0.38
▸ TRPV1 Q8NER1 1/20 0.36
▸ NPY5R Q15761 1/20 0.36
▸ KCNA5 P22460 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
SCHEMBL25786687 0.92 SMN1; SMN2 (0.47) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL20552654 0.87 SMN1; SMN2 (0.43) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL25786698 0.85 SMN1; SMN2 (0.42) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL21749297 0.85 HDAC6 (0.47) RAB9ATP53SMN1; SMN2ABCG2HDAC6
SCHEMBL21749269 0.85 ABCG2 (0.46) RAB9ALMNATP53SMN1; SMN2ABCG2
SCHEMBL20552643 0.84 ABCG2 (0.47) LMNATP53SMN1; SMN2ABCG2HDAC6
SCHEMBL20552624 0.83 ABCG2 (0.47) LMNATP53SMN1; SMN2ABCG2HDAC6
SCHEMBL21749276 0.83 ABCG2 (0.44) LMNATP53SMN1; SMN2ABCG2HDAC6
SCHEMBL25786689 0.82 SMN1; SMN2 (0.41) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL21749247 0.82 HIF1A (0.45) RAB9ATP53ABCG2NR3C1HDAC6

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 NPC1 1229/4885RAB9A 953/4885LMNA 2034/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 NPC1 1229/4885RAB9A 953/4885LMNA 2034/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 NPC1 2127/4885RAB9A 1922/4885LMNA 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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