SCHEMBL21624753

SCHEMBL21624753

CC(C)c1ccc(CC(=O)NC2CCN(C(=O)O)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ EPHX2 P34913 3/20 0.47
▸ USP30 Q70CQ3 2/20 0.47
▸ SIGMAR1 Q99720 7/20 0.47
▸ LMNA P02545 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ CNR2 P34972 1/20 0.45

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
SCHEMBL21624752 1.00 MEN1 (0.50) MEN1KMT2AEPHX2USP30SIGMAR1
SCHEMBL24244092 0.85 L3MBTL1 (0.50) KMT2AEPHX2USP30SIGMAR1LMNA
SCHEMBL23750364 0.85 L3MBTL1 (0.50) KMT2AEPHX2USP30SIGMAR1LMNA
SCHEMBL29689880 0.84 NPC1 (0.62) MEN1KMT2AEPHX2USP30L3MBTL1
SCHEMBL21624784 0.82 USP30 (0.49) MEN1KMT2AUSP30SIGMAR1LMNA
SCHEMBL21624785 0.82 USP30 (0.49) MEN1KMT2AUSP30SIGMAR1LMNA
SCHEMBL14924027 0.82 L3MBTL1 (0.55) MEN1KMT2AEPHX2SIGMAR1LMNA
SCHEMBL23387283 0.80 SIGMAR1 (0.64) MEN1KMT2AEPHX2USP30SIGMAR1
SCHEMBL23387280 0.80 SIGMAR1 (0.64) MEN1KMT2AEPHX2USP30SIGMAR1
SCHEMBL23387204 0.79 ALDH1A1 (0.68) MEN1KMT2AEPHX2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220226299-A1 USE OF T-TYPE CALCIUM CHANNEL BLOCKER FOR TREATING PRURITUS NIPPON CHEMIPHAR CO., LTD. (JP) 2022-07-21 — — US disclosed
EP-3950059-A1 USE OF T-TYPE CALCIUM CHANNEL BLOCKER FOR TREATING PRURITUS Nippon Chemiphar Co., Ltd. (JP) 2022-02-09 — — EP disclosed
EP-3825303-A1 T-TYPE CALCIUM CHANNEL BLOCKER Nippon Chemiphar Co., Ltd. (JP) 2021-05-26 — — EP disclosed
WO-2020017569-A1 T-TYPE CALCIUM CHANNEL BLOCKER 日本ケミファ株式会社 2020-01-23 — — 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 (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-20220226299-A1 USE OF T-TYPE CALCIUM CHANNEL BLOCKER FOR TREATING PRURITUS TRPV3, CACNA1G, TRPV2 MEN1 2841/4885KMT2A 2174/4885EPHX2 3565/4885

“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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