SCHEMBL26902789

SCHEMBL26902789

Cc1ccc(-c2cnc([C@H](CCCNC(=N)CF)NC(=O)c3ccc4cc(N(C)C)ccc4c3)o2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 6/20 0.36
▸ HDAC6 Q9UBN7 5/20 0.36
▸ HDAC3 O15379 4/20 0.36
▸ HDAC4 P56524 3/20 0.36
▸ HDAC7 Q8WUI4 3/20 0.36
▸ HDAC2 Q92769 3/20 0.36
▸ HDAC10 Q969S8 3/20 0.36
▸ HDAC11 Q96DB2 3/20 0.36
▸ HDAC8 Q9BY41 3/20 0.36
▸ HDAC9 Q9UKV0 3/20 0.36
▸ HDAC5 Q9UQL6 3/20 0.36
▸ UTS2R Q9UKP6 7/20 0.36
▸ PDE4A P27815 2/20 0.35
▸ PDE4B Q07343 2/20 0.35
▸ PDE4C Q08493 2/20 0.35
▸ PDE4D Q08499 2/20 0.35
▸ PADI6 Q6TGC4 1/20 0.35
▸ PADI4 Q9UM07 1/20 0.35
▸ PADI2 Q9Y2J8 1/20 0.35
▸ ROCK2 O75116 2/20 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
SCHEMBL24301584 0.93 UTS2R (0.38) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL26667458 0.93 UTS2R (0.38) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL24301582 0.93 PDE4A (0.41) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL24301580 0.93 PDE4A (0.41) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL29717153 0.93 PDE4A (0.41) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL24302112 0.93 HDAC3 (0.36) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL29717165 0.89 PDE4A (0.36) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL26667444 0.89 PDE4A (0.36) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL24302411 0.89 PDE4A (0.36) HDAC1HDAC6HDAC3HDAC4HDAC7
Hydrochloric Acid SCHEMBL29717129 0.88 PDE4A (0.37) HDAC1HDAC6HDAC3HDAC4HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230381146-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND USE THEREOF HELIOS HUAMING BIOPHARMA CO., LTD. (CN) 2023-11-30 — — US disclosed
US-20230381146-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND USE THEREOF HELIOS HUAMING BIOPHARMA CO., LTD. (CN) 2023-11-30 — — 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 (1 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-20230381146-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND USE THEREOF SSB, BTK, PADI6 HDAC1 987/4885HDAC6 194/4885HDAC3 346/4885

“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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