SCHEMBL25523231

SCHEMBL25523231

CC(C)CCc1ccc(C(=O)C(C)N)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 7/20 0.43
▸ GRIN2D O15399 1/20 0.42
▸ GRIN2A Q12879 1/20 0.42
▸ GRIN2B Q13224 1/20 0.42
▸ GRIN2C Q14957 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CYP4F2 P78329 1/20 0.40
▸ CYP4A11 Q02928 1/20 0.40
▸ S1PR2 O95136 2/20 0.39
▸ S1PR1 P21453 2/20 0.39
▸ MMP12 P39900 1/20 0.39
▸ MMP13 P45452 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ S1PR3 Q99500 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.37

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
SCHEMBL25516477 0.85 KDM4E (0.44) DPP4GRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL20440713 0.82 CYP4F2 (0.40) DPP4KMT2AMEN1HTTSMN1; SMN2
SCHEMBL25522757 0.82 GRIN2D (0.42) DPP4GRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL8293310 0.81 DPP4 (0.56) DPP4GRIN2DGRIN2AGRIN2BGRIN2C
Ammonia Solution, Strong SCHEMBL11119550 0.80 DPP4 (0.55) DPP4GRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL12018041 0.79 KMT2A (0.57) GRIN2DGRIN2AGRIN2BGRIN2CKMT2A
SCHEMBL9559796 0.79 ALDH1A1 (0.55) HTTSMN1; SMN2CYP4F2CYP4A11
SCHEMBL16868406 0.79 ALDH1A1 (0.55) HTTSMN1; SMN2CYP4F2CYP4A11
SCHEMBL21753375 0.79 SLC6A2 (0.46) KMT2ASMN1; SMN2CYP4F2CYP4A11HPGD
SCHEMBL104594 0.79 GRIN2D (0.57) GRIN2DGRIN2AGRIN2BGRIN2CKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159569-A1 DUAL HDAC6/PROTEASOME INHIBITORS, AND METHODS OF USE THEREOF UNIVERSITY OF MARYLAND, BALTIMORE (US) 2023-05-25 — — 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-20230159569-A1 DUAL HDAC6/PROTEASOME INHIBITORS, AND METHODS OF USE THEREOF HDAC6, PSMG3, PSMB2 DPP4 1682/4885GRIN2D 2603/4885GRIN2A 1908/4885

“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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