SCHEMBL21424360

SCHEMBL21424360

CC(C)c1ccc(CC(=O)N[C@H]2CCNC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.49
▸ KMT2A Q03164 3/20 0.46
▸ POLB P06746 1/20 0.46
▸ CNR2 P34972 1/20 0.45
▸ KDM1A O60341 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ NLRP3 Q96P20 1/20 0.43
▸ EPHX2 P34913 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ GRM7 Q14831 1/20 0.41

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
SCHEMBL21624691 1.00 LMNA (0.49) LMNAKMT2APOLBCNR2KDM1A
SCHEMBL21624693 1.00 LMNA (0.49) LMNAKMT2APOLBCNR2KDM1A
SCHEMBL21624779 0.92 LMNA (0.55) LMNAKMT2APOLBCNR2MEN1
SCHEMBL23387364 0.89 LMNA (0.50) LMNAKMT2APOLBCNR2MEN1
SCHEMBL15054874 0.82 SIGMAR1 (0.52) LMNAKMT2APOLBKDM1AMEN1
SCHEMBL34468348 0.82 SIGMAR1 (0.52) LMNAKMT2APOLBKDM1AMEN1
SCHEMBL30718482 0.81 EPHX2 (0.62) KMT2AKDM1AMEN1EPHX2ALDH1A1
SCHEMBL15055182 0.81 EPHX2 (0.62) KMT2AKDM1AMEN1EPHX2ALDH1A1
SCHEMBL34468338 0.81 EPHX2 (0.62) KMT2AKDM1AMEN1EPHX2ALDH1A1
SCHEMBL13883884 0.81 HDAC4 (0.50) LMNAKMT2AMEN1NPC1RAB9A

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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2023-10-12 — — US disclosed
US-11547709-B2 Methods of treating disorders associated with castor ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. (US) 2023-01-10 — — US disclosed
US-20210023081-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2021-01-28 — — US disclosed
US-20190300499-A1 SMALL MOLECULE MODULATORS OF PANTOTHENATE KINASES ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2019-10-03 — — 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 (4 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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR HMGCR, GCDH, CYP11A1 LMNA 1621/4885KMT2A 1296/4885POLB 1599/4885
US-11547709-B2 Methods of treating disorders associated with castor HMGCR, GCDH, CYP11A1 LMNA 1621/4885KMT2A 1296/4885POLB 1599/4885
US-20210023081-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR HMGCR, GCDH, CYP11A1 LMNA 1621/4885KMT2A 1296/4885POLB 1599/4885
US-20190300499-A1 SMALL MOLECULE MODULATORS OF PANTOTHENATE KINASES PANK2, PANK1, PANK3 LMNA 1792/4885KMT2A 1775/4885POLB 1901/4885

“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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