SCHEMBL17006348

SCHEMBL17006348

CCN1CCc2c(sc(NC(=O)O)c2C(=O)N/C(C)=N/O)C1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 9/20 0.50
▸ ALDH1A1 P00352 4/20 0.49
▸ MAPT P10636 4/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ KDM4E B2RXH2 3/20 0.49
▸ HPGD P15428 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ GAA P10253 3/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ KCNH2 Q12809 2/20 0.48
▸ MITF O75030 2/20 0.47
▸ RAD52 P43351 2/20 0.47
▸ USP2 O75604 1/20 0.46
▸ PSMD14 O00487 1/20 0.46

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
SCHEMBL17006351 1.00 KMT2A (0.50) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL17018758 0.86 RAD52 (0.45) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL16962836 0.84 KMT2A (0.58) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL16962841 0.75 ALDH1A1 (0.55) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL13740208 0.74 KMT2A (0.64) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL16962878 0.73 KCNH2 (0.71) KMT2AALDH1A1MAPTMEN1KDM4E
Hydrochloric Acid SCHEMBL16962172 0.72 KCNH2 (0.71) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL19475106 0.72 KMT2A (0.60) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL20915150 0.71 KMT2A (0.52) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL17018760 0.70 KMT2A (0.50) KMT2AALDH1A1MAPTMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9902738-B2 Compounds and methods for preventing, treating and/or protecting against sensory hair cell death UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2018-02-27 — — US disclosed
EP-2900674-B1 COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH UNIV WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2017-05-31 — — EP disclosed
US-20160326186-A1 COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH FRED HUTCHINSON CANCER CENTER 2016-11-10 — — US disclosed
US-9416141-B2 Compounds and methods for preventing, treating and/or protecting against sensory hair cell death UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2016-08-16 — — US disclosed
US-20150232476-A1 COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION 2015-08-20 — — 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 (2 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-20160326186-A1 COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH BAX, CASP3, BCL2 KMT2A 4772/4885ALDH1A1 426/4885MAPT 2252/4885
US-20150232476-A1 COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH BAX, CASP3, BCL2 KMT2A 4772/4885ALDH1A1 426/4885MAPT 2252/4885

“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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