SCHEMBL15416016

SCHEMBL15416016

c1ccc(N2CCN=N2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLD1 Q13393 1/20 0.47
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
KDM4E B2RXH2 5/20 0.42
POLB P06746 1/20 0.41
CRBN Q96SW2 1/20 0.41
ALOX5 P09917 1/20 0.41
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 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
SCHEMBL17171677 0.74 KDM4E (0.39) KDM4EPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL29857922 0.72 PLD1 (0.73) PLD1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL21353591 0.72
SCHEMBL15800694 0.72 PLD1 (0.73) PLD1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7787172 0.71 PLD1 (0.46) PLD1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL936111 0.70 MAPT (0.44) KDM4EPOLBSMN1; SMN2MAPTMEN1
SCHEMBL5319 0.69 PLD1 (0.63) PLD1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL14088081 0.68 HRH3 (0.41) KDM4ESMN1; SMN2MAPTCYP2D6
SCHEMBL29462629 0.68 PLD1 (0.68) PLD1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL18228078 0.68 PLD1 (0.68) PLD1GRIN2DGRIN3BGRIN1GRIN2A

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4069709-B1 METAL COMPLEXES UDC IRELAND LTD (IE) 2025-04-23 EP claimed
EP-4069709-A1 METAL COMPLEXES Merck Patent GmbH (DE) 2022-10-12 EP claimed
WO-2021110720-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2021-06-10 WO claimed
EP-2872590-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2018-11-14 EP claimed
EP-2906575-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2018-01-17 EP claimed
EP-2906575-A1 METAL COMPLEXES Merck Patent GmbH (DE) 2015-08-19 EP claimed
WO-2014056564-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-04-17 WO claimed
EP-4069709-B1 METAL COMPLEXES UDC IRELAND LTD (IE) 2025-04-23 EP disclosed
EP-4069709-A1 METAL COMPLEXES Merck Patent GmbH (DE) 2022-10-12 EP disclosed
EP-3956338-A1 METAL COMPLEXES Merck Patent GmbH (DE) 2022-02-23 EP disclosed
WO-2021110720-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2021-06-10 WO disclosed
EP-3424936-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2021-04-07 EP disclosed
EP-3478698-B1 METHOD FOR THE SEPARATION OF ENANTIOMERIC MIXTURES FROM METAL COMPLEXES MERCK PATENT GMBH (DE) 2021-01-13 EP disclosed
EP-2906575-A1 METAL COMPLEXES Merck Patent GmbH (DE) 2015-08-19 EP disclosed
EP-2882763-A2 METAL COMPLEXES Merck Patent GmbH (DE) 2015-06-17 EP disclosed
EP-2872590-A1 METAL COMPLEXES Merck Patent GmbH (DE) 2015-05-20 EP disclosed
WO-2014056564-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-04-17 WO disclosed
WO-2014044347-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-03-27 WO disclosed
WO-2014023377-A2 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-02-13 WO disclosed
WO-2014008982-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-01-16 WO disclosed