SCHEMBL18285387

SCHEMBL18285387

[2H]C([2H])([2H])Oc1ccc(NN)cn1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.51
KMT2A Q03164 10/20 0.41
MEN1 O00255 9/20 0.41
KDM4E B2RXH2 4/20 0.41
MAPT P10636 2/20 0.41
RAB9A P51151 3/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
POLB P06746 3/20 0.39
PABPC1 P11940 6/20 0.39
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL29896362 1.00 NNMT (0.51) NNMTKMT2AMEN1KDM4EMAPT
SCHEMBL31252505 0.86 KMT2A (0.51) NNMTKMT2AMEN1KDM4EMAPT
SCHEMBL1491147 0.86 KMT2A (0.51) NNMTKMT2AMEN1KDM4EMAPT
Hydrochloric Acid SCHEMBL2917342 0.85 KMT2A (0.50) NNMTKMT2AMEN1KDM4EMAPT
Hydrochloric Acid SCHEMBL5148687 0.85 KMT2A (0.50) NNMTKMT2AMEN1KDM4EMAPT
SCHEMBL20962582 0.76 MAPT (0.47) KMT2AMEN1KDM4EMAPTALDH1A1
SCHEMBL29896316 0.75
SCHEMBL2230245 0.75
SCHEMBL29461641 0.75
Hydrochloric Acid SCHEMBL28689142 0.74 MAPT (0.46) KMT2AMEN1KDM4EMAPTALDH1A1

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-11427582-B2 Ligands selective to alpha 6 subunit-containing GABAA receptors and their methods of use UWM RESEARCH FOUNDATION, INC. (US) 2022-08-30 US disclosed
US-20210047322-A1 LIGANDS SELECTIVE TO ALPHA 6 SUBUNIT-CONTAINING GABAA RECEPTORS AND THEIR METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-02-18 US disclosed
US-10865203-B2 Ligands selective to alpha 6 subunit-containing GABAA receptors and their methods of use UWM RESEARCH FOUNDATION, INC. (US) 2020-12-15 US disclosed
EP-3325479-B1 LIGANDS SELECTIVE TO ALPHA 6 SUBUNIT-CONTAINING GABAA RECEPTORS AND THEIR METHODS OF USE UWM RES FOUNDATION INC (US) 2020-12-02 EP disclosed
EP-3325479-A1 LIGANDS SELECTIVE TO ALPHA 6 SUBUNIT-CONTAINING GABAa RECEPTORS ANS THEIR METHODS OF USE UWM Research Foundation, Inc. (US) 2018-05-30 EP disclosed
US-20180134698-A1 LIGANDS SELECTIVE TO ALPHA 6 SUBUNIT-CONTAINING GABAA RECEPTORS AND THEIR METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-05-17 US disclosed
WO-2016196961-A1 LIGANDS SELECTIVE TO ALPHA 6 SUBUNIT-CONTAINING GABAA RECEPTORS ANS THEIR METHODS OF USE UWM RESEARCH FOUNDATION, INC. (US) 2016-12-08 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 (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-20210047322-A1 LIGANDS SELECTIVE TO ALPHA 6 SUBUNIT-CONTAINING GABAA RECEPTORS AND THEIR METHODS OF USE GABRA6, HTR6, GABRD NNMT 1051/4885KMT2A 3519/4885MEN1 3061/4885
US-20180134698-A1 LIGANDS SELECTIVE TO ALPHA 6 SUBUNIT-CONTAINING GABAA RECEPTORS AND THEIR METHODS OF USE GABRA6, HTR6, GABRD NNMT 1201/4885KMT2A 3756/4885MEN1 3268/4885
US-11427582-B2 Ligands selective to alpha 6 subunit-containing GABAA receptors and their methods of use GABRA6, HTR6, GABRD NNMT 1051/4885KMT2A 3519/4885MEN1 3061/4885
US-10865203-B2 Ligands selective to alpha 6 subunit-containing GABAA receptors and their methods of use GABRA6, HTR6, GABRD NNMT 1201/4885KMT2A 3756/4885MEN1 3268/4885

“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.