SCHEMBL14406411

SCHEMBL14406411

CC(=O)Oc1ccc2c(c1)C(C)=CC(C)(C)N2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 15/20 0.66
▸ LMNA P02545 10/20 0.66
▸ HTT P42858 9/20 0.66
▸ NPSR1 Q6W5P4 7/20 0.66
▸ TP53 P04637 3/20 0.66
▸ KDM4E B2RXH2 9/20 0.62
▸ L3MBTL1 Q9Y468 5/20 0.62
▸ HSD17B10 Q99714 4/20 0.62
▸ TDP1 Q9NUW8 4/20 0.62
▸ G6PD P11413 2/20 0.62
▸ GFER P55789 1/20 0.62
▸ ALDH1A1 P00352 10/20 0.62
▸ MEN1 O00255 7/20 0.62
▸ KMT2A Q03164 7/20 0.62
▸ HPGD P15428 6/20 0.62
▸ ALOX15 P16050 2/20 0.62
▸ ALOX12 P18054 2/20 0.62
▸ CYP1A2 P05177 1/20 0.62
▸ CYP3A4 P08684 1/20 0.62
▸ CYP2D6 P10635 1/20 0.62

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
SCHEMBL3378751 0.89 MAPT (0.66) MAPTLMNAHTTNPSR1TP53
SCHEMBL11598567 0.82 LMNA (0.65) MAPTLMNAHTTNPSR1TP53
SCHEMBL12670563 0.82 MAPT (0.67) MAPTLMNAHTTNPSR1TP53
E324 SCHEMBL10356767 0.81 ALDH1A1 (0.85) MAPTLMNAHTTNPSR1TP53
SCHEMBL12633824 0.81 MAPT (0.66) MAPTLMNAHTTNPSR1TP53
SCHEMBL12633826 0.81 MAPT (0.62) MAPTLMNAHTTNPSR1TP53
SCHEMBL12671045 0.79 MAPT (0.66) MAPTLMNAHTTNPSR1TP53
SCHEMBL12633828 0.79 MAPT (0.64) MAPTLMNAHTTNPSR1TP53
SCHEMBL12633827 0.79 MAPT (0.64) MAPTLMNAHTTNPSR1TP53
E324 SCHEMBL9767913 0.79 ALDH1A1 (0.85) MAPTLMNAHTTNPSR1TP53

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 3 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-20140303203-A1 COMPOUNDS FOR TREATING PERIPHERAL; NEUROPATHIES AND OTHER NEURODEGENERATIVE; DISORDERS THE JOHNS HOPKINS UNIVERSITY (US) 2014-10-09 — — US disclosed
WO-2012177831-A2 COMPOUNDS FOR TREATING PERIPHERAL NEUROPATHIES AND OTHER NEURODEGENERATIVE DISORDERS THE JOHNS HOPKINS UNIVERSITY (US) 2012-12-27 — — 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-20140303203-A1 COMPOUNDS FOR TREATING PERIPHERAL; NEUROPATHIES AND OTHER NEURODEGENERATIVE; DISORDERS HSP90AB1, HSP90AA1, HSP90AB2P MAPT 43/4885LMNA 3007/4885HTT 34/4885

“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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