SCHEMBL2403475

SCHEMBL2403475

Cc1nc(N2CCN(C)CC2)c2nnnn2c1-c1cccs1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.47
▸ GBA1 P04062 2/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ HRH4 Q9H3N8 4/20 0.44
▸ HRH3 Q9Y5N1 2/20 0.44
▸ KDM4E B2RXH2 4/20 0.43
▸ MAPT P10636 3/20 0.43
▸ HTT P42858 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ POLB P06746 2/20 0.43
▸ HPGD P15428 2/20 0.41
▸ USP2 O75604 2/20 0.40
▸ HBB P68871 1/20 0.40

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
SCHEMBL12269552 0.82 LMNA (0.48) LMNAGBA1MEN1KMT2AALDH1A1
SCHEMBL2401793 0.78 ALDH1A1 (0.48) LMNAGBA1MEN1KMT2AALDH1A1
SCHEMBL2402127 0.73 HRH4 (0.55) MEN1KMT2AALDH1A1L3MBTL1HRH4
SCHEMBL12225319 0.73 MAPT (0.76) MEN1KMT2AALDH1A1L3MBTL1HRH4
SCHEMBL14785803 0.72 ALDH1A1 (0.42) LMNAGBA1MEN1KMT2AALDH1A1
Water SCHEMBL14783137 0.71 ALDH1A1 (0.42) LMNAGBA1MEN1KMT2AALDH1A1
SCHEMBL2400813 0.71 MET (0.46) LMNAGBA1MEN1KMT2AALDH1A1
Cadaverine Tartrate SCHEMBL14786006 0.70 ALDH1A1 (0.40) LMNAGBA1MEN1KMT2AALDH1A1
Cadaverine Tartrate SCHEMBL14785947 0.69 ALDH1A1 (0.40) LMNAGBA1MEN1KMT2AALDH1A1
Cadaverine Tartrate SCHEMBL14785907 0.69 ALDH1A1 (0.40) LMNAGBA1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2545058-B1 TETRAZOLO[1,5-a]PYRAZINE COMPOUNDS AS INHIBITORS OF HISTAMINE RECEPTORS KALYPSYS INC (US) 2016-08-24 — — EP disclosed
US-8569300-B2 Substituted tetrazolo[1,5-A]pyrazine inhibitors of histamine receptors for the treatment of disease KALYPSYS INC. (US) 2013-10-29 — — US disclosed
US-8569300-B2 Substituted tetrazolo[1,5-A]pyrazine inhibitors of histamine receptors for the treatment of disease KALYPSYS INC. (US) 2013-10-29 — — US disclosed
US-8569300-B2 Substituted tetrazolo[1,5-A]pyrazine inhibitors of histamine receptors for the treatment of disease KALYPSYS INC. (US) 2013-10-29 — — US disclosed
EP-2545058-A2 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE Kalypsys, Inc. (US) 2013-01-16 — — EP disclosed
US-20110237565-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2011-09-29 — — US disclosed
US-20110237565-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2011-09-29 — — US disclosed
US-20110237565-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2011-09-29 — — US disclosed
WO-2011112766-A2 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2011-09-15 — — 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-20110237565-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE HRH4, HRH3, HRH2 LMNA 4737/4885GBA1 1531/4885MEN1 1013/4885

“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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