SCHEMBL3937876

SCHEMBL3937876

NC(=O)c1c(N)sc2c1CCN(C(=O)O)C2

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.67
KDM4E B2RXH2 10/20 0.67
MAPT P10636 10/20 0.67
HPGD P15428 7/20 0.67
MEN1 O00255 6/20 0.67
KMT2A Q03164 6/20 0.67
GLA P06280 1/20 0.67
GAA P10253 1/20 0.62
ADORA1 P30542 5/20 0.55
HSD17B10 Q99714 3/20 0.55
USP2 O75604 1/20 0.55
RECQL P46063 1/20 0.55
RAD52 P43351 1/20 0.55
ALOX15 P16050 3/20 0.54
MAPK1 P28482 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.47
BPTF Q12830 1/20 0.47
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ANO1 Q5XXA6 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
SCHEMBL16960408 0.91 ALDH1A1 (0.60) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL29229875 0.89 ADORA1 (0.68) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL20838883 0.83 MAPT (0.56) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL5342374 0.82 MAPT (0.63) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL8288691 0.81 ADORA1 (0.68) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL30222268 0.81 MAPT (0.61) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL2101660 0.80 KDM4E (1.00) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL19475087 0.80 ADORA1 (0.73) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL351992 0.80 ADORA1 (0.82) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL13738436 0.78 ADORA1 (0.58) ALDH1A1KDM4EMAPTMEN1KMT2A

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 8 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
EP-2900674-A1 COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH University of Washington through its Center for Commercialization (US) 2015-08-05 EP disclosed
EP-2041124-A1 PYRAZOLEALKANAMIDE SUBSTITUTED THIOPHENES AS AMPA POTENTIATORS N.V. Organon (NL) 2009-04-01 EP disclosed
WO-2008003452-A1 PYRAZOLEALKANAMIDE SUBSTITUTED THIOPHENES AS AMPA POTENTIATORS N.V. ORGANON (NL) 2008-01-10 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 (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 ALDH1A1 426/4885KDM4E 4348/4885MAPT 2252/4885
US-20150232476-A1 COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH BAX, CASP3, BCL2 ALDH1A1 426/4885KDM4E 4348/4885MAPT 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.