SCHEMBL21749297

SCHEMBL21749297

FC(F)(F)c1ccc(Nc2ccccc2-c2nnn(Cc3ccncc3)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 3/20 0.47
▸ FLT1 P17948 3/20 0.44
▸ KDR P35968 3/20 0.44
▸ ABCG2 Q9UNQ0 7/20 0.43
▸ RAB9A P51151 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HIF1A Q16665 1/20 0.40
▸ EPAS1 Q99814 1/20 0.40
▸ TAS2R14 Q9NYV8 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ ABCB1 P08183 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38

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
SCHEMBL25786607 0.93 HDAC6 (0.41) HDAC6FLT1KDRABCG2RAB9A
SCHEMBL21749247 0.90 HIF1A (0.45) HDAC6ABCG2RAB9AL3MBTL1HIF1A
SCHEMBL21749272 0.88 FLT1 (0.47) FLT1KDRRAB9AL3MBTL1TP53
SCHEMBL25786690 0.86 FLT1 (0.40) FLT1KDRRAB9AL3MBTL1TP53
SCHEMBL20552643 0.85 ABCG2 (0.47) HDAC6ABCG2TAS2R14TP53ABCB1
SCHEMBL20552624 0.85 ABCG2 (0.47) HDAC6ABCG2TAS2R14TP53ABCB1
SCHEMBL21749304 0.85 NPC1 (0.46) HDAC6ABCG2RAB9ATAS2R14TP53
SCHEMBL21749269 0.84 ABCG2 (0.46) HDAC6ABCG2RAB9ATAS2R14TP53
SCHEMBL25787424 0.83 TP53 (0.49) HDAC6ABCG2TAS2R14TP53ABCB1
SCHEMBL20552265 0.83 ABCG2 (0.45) HDAC6ABCG2TAS2R14TP53ABCB1

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 HDAC6 551/4885FLT1 2930/4885KDR 1806/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 HDAC6 551/4885FLT1 2930/4885KDR 1806/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 HDAC6 921/4885FLT1 4483/4885KDR 4727/4885

“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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