SCHEMBL8849533

SCHEMBL8849533

CC(=O)N1c2ccc(O)cc2C(C)=CC1(C)C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.66
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
NPSR1 Q6W5P4 4/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CRHBP P24387 1/20 0.52
CYP2C19 P33261 1/20 0.52
ATM Q13315 1/20 0.52
CRHR2 Q13324 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.49
POLB P06746 1/20 0.49
ALDH1A1 P00352 10/20 0.47
KDM4E B2RXH2 6/20 0.47
MAPT P10636 6/20 0.47
ALOX12 P18054 5/20 0.47
GAA P10253 4/20 0.47
HTT P42858 3/20 0.47
HPGD P15428 3/20 0.47

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
SCHEMBL29677278 0.84 LMNA (0.64) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL19478438 0.84 LMNA (0.64) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL7038965 0.84 LMNA (0.64) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL12508055 0.80 LMNA (0.59) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL14406408 0.80 KMT2A (0.64) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL25198969 0.80 LMNA (0.62) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL29522421 0.80 LMNA (1.00) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL25204645 0.78 ALDH1A1 (0.74) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL6567228 0.78 ALDH1A1 (0.65) LMNAKMT2AMEN1NPSR1CYP1A2
SCHEMBL10001894 0.78 AR (0.41) LMNAKMT2AMEN1NPSR1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9527817-B2 Compounds for treating peripheral; neuropathies and other neurodegenerative; disorders THE JOHNS HOPKINS UNIVERSITY (US) 2016-12-27 US disclosed
US-9527817-B2 Compounds for treating peripheral; neuropathies and other neurodegenerative; disorders THE JOHNS HOPKINS UNIVERSITY (US) 2016-12-27 US disclosed
US-20140303203-A1 COMPOUNDS FOR TREATING PERIPHERAL; NEUROPATHIES AND OTHER NEURODEGENERATIVE; DISORDERS THE JOHNS HOPKINS UNIVERSITY (US) 2014-10-09 US disclosed
US-20140303203-A1 COMPOUNDS FOR TREATING PERIPHERAL; NEUROPATHIES AND OTHER NEURODEGENERATIVE; DISORDERS THE JOHNS HOPKINS UNIVERSITY (US) 2014-10-09 US disclosed
US-5627192-A ANTILIPEMIC AGENTS, ANTICHOLESTEROL AGENTS OR ANTIOXIDANTS BRISTROL-MYERS SQUIBB COMPANY (US) 1997-05-06 US disclosed
US-5411969-A Antihyperlipidemic/antioxidant dihydroquinolines BRISTOL-MYERS SQUIBB COMPANY (US) 1995-05-02 US disclosed
US-5391765-A Lowers low density lipoproteins BRISTOL-MYERS SQUIBB COMPANY (US) 1995-02-21 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-20140303203-A1 COMPOUNDS FOR TREATING PERIPHERAL; NEUROPATHIES AND OTHER NEURODEGENERATIVE; DISORDERS HSP90AB1, HSP90AA1, HSP90AB2P LMNA 3007/4885KMT2A 4456/4885MEN1 4593/4885

“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.