SCHEMBL20552622

SCHEMBL20552622

OCCn1nnc(-c2cc(C(F)F)ccc2Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ EIF2AK2 P19525 2/20 0.36
▸ KDR P35968 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ ABCG2 Q9UNQ0 1/20 0.35
▸ TEAD1 P28347 1/20 0.35
▸ YAP1 P46937 1/20 0.35
▸ AKR1C3 P42330 1/20 0.34
▸ AKR1C2 P52895 1/20 0.34
▸ TP53 P04637 3/20 0.34
▸ GAA P10253 1/20 0.33
▸ DDX3X O00571 1/20 0.33
▸ THRB P10828 1/20 0.33

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
SCHEMBL25781529 0.90 MAPT (0.38) HDAC6ALDH1A1LMNAMAPTABCG2
SCHEMBL20552644 0.89 HDAC6 (0.42) HDAC6ALDH1A1LMNAEIF2AK2KDR
SCHEMBL20552684 0.86 HDAC6 (0.40) HDAC6ALDH1A1LMNAEIF2AK2KDR
SCHEMBL20552214 0.86 HDAC6 (0.43) HDAC6ALDH1A1LMNAEIF2AK2KDR
SCHEMBL20553430 0.85 MAPT (0.41) HDAC6ALDH1A1LMNAEIF2AK2KDR
SCHEMBL20552757 0.85 HDAC6 (0.42) HDAC6ALDH1A1LMNAEIF2AK2KDR
SCHEMBL20552985 0.85 ABCG2 (0.43) HDAC6ALDH1A1LMNAEIF2AK2KDR
SCHEMBL20551828 0.84 HDAC6 (0.43) HDAC6ALDH1A1LMNAMAPTABCG2
SCHEMBL25788904 0.83 LMNA (0.33) ALDH1A1LMNAMAPTABCG2TEAD1
SCHEMBL20552419 0.83 ABCG2 (0.42) HDAC6MAPTABCG2TP53

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 (2 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 551/4885ALDH1A1 3497/4885LMNA 2034/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 HDAC6 551/4885ALDH1A1 3497/4885LMNA 2034/4885

“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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