SCHEMBL11539502

SCHEMBL11539502

CC(C)(C)C(=O)On1nnc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 3/20 0.57
▸ HDAC4 P56524 3/20 0.57
▸ HDAC1 Q13547 3/20 0.57
▸ HDAC7 Q8WUI4 3/20 0.57
▸ HDAC2 Q92769 3/20 0.57
▸ HDAC10 Q969S8 3/20 0.57
▸ HDAC11 Q96DB2 3/20 0.57
▸ HDAC8 Q9BY41 3/20 0.57
▸ HDAC6 Q9UBN7 3/20 0.57
▸ HDAC9 Q9UKV0 3/20 0.57
▸ HDAC5 Q9UQL6 3/20 0.57
▸ SIRT2 Q8IXJ6 4/20 0.55
▸ SIRT1 Q96EB6 1/20 0.47
▸ SIRT3 Q9NTG7 1/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TSHR P16473 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL2608492 0.82 HDAC3 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL12604847 0.82 HDAC3 (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL39113 0.82 SIRT2 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29773981 0.82 SIRT2 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1562975 0.82 SIRT2 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6539398 0.81 HDAC3 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL19688871 0.81 HDAC3 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11138777 0.81 HDAC3 (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL27601670 0.81 SIRT2 (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL25734944 0.81 HPSE (0.50) NPC1RAB9ASMN1; SMN2TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11857635-B2 Linker compound, polyethylene glycol-linker conjugate and derivative thereof and polyethylene glycol-linker-drug conjugate JENKEM TECHNOLOGY CO., LTD. (TIANJIN) (CN) 2024-01-02 — — US disclosed
US-11857635-B2 Linker compound, polyethylene glycol-linker conjugate and derivative thereof and polyethylene glycol-linker-drug conjugate JENKEM TECHNOLOGY CO., LTD. (TIANJIN) (CN) 2024-01-02 — — US disclosed
US-20230364277-A1 E-SELECTIN TARGETING AGENTS GLYCOMIMETICS, INC. (US) 2023-11-16 — — US disclosed
US-20230167149-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS GLYCOMIMETICS, INC. (US) 2023-06-01 — — US disclosed
US-20230167150-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS GLYCOMIMETICS, INC. (US) 2023-06-01 — — US disclosed
US-20230167149-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS GLYCOMIMETICS, INC. (US) 2023-06-01 — — US disclosed
US-20200289655-A1 Linker Compound, Polyethylene Glycol-Linker Conjugate and Derivative Thereof and Polyethylene Glycol-Linker-Drug Conjugate JENKEM TECHNOLOGY CO., LTD. (TIANJIN) (CN) 2020-09-17 — — US disclosed
US-4174285-A OIL ADDITIVES MOBIL OIL CORPORATION (US) 1979-11-13 — — 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 (5 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-20230167150-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS SIGLEC7, SIGLEC9, CD47 HDAC3 2208/4885HDAC4 2708/4885HDAC1 2523/4885
US-20200289655-A1 Linker Compound, Polyethylene Glycol-Linker Conjugate and Derivative Thereof and Polyethylene Glycol-Linker-Drug Conjugate DCLRE1A, LANCL2, SI HDAC3 1434/4885HDAC4 790/4885HDAC1 1482/4885
US-20230167149-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS SIGLEC7, SIGLEC9, ASGR1 HDAC3 2157/4885HDAC4 2709/4885HDAC1 2615/4885
US-20230364277-A1 E-SELECTIN TARGETING AGENTS SELE, SELPLG, SELP HDAC3 4088/4885HDAC4 3388/4885HDAC1 3328/4885
US-11857635-B2 Linker compound, polyethylene glycol-linker conjugate and derivative thereof and polyethylene glycol-linker-drug conjugate DCLRE1A, LANCL2, SI HDAC3 1434/4885HDAC4 790/4885HDAC1 1482/4885

“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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