SCHEMBL21609759

SCHEMBL21609759

CCN(CC)CCCNC(=O)c1cccc(C2=C3C(=O)NC(c4ccc(Sc5ccccc5)cc4)=C3C(=O)N2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
CAMK2D Q13557 1/20 0.42
METAP2 P50579 1/20 0.41
POLB P06746 1/20 0.41
ACKR3 P25106 1/20 0.40
TMEM97 Q5BJF2 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
CYP2D6 P10635 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
MAPT P10636 2/20 0.40
TSHR P16473 1/20 0.40
APP P05067 1/20 0.39

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
SCHEMBL21609758 0.87 MAPK1 (0.48) DRD2DRD4DRD3KMT2AMEN1
SCHEMBL30038995 0.87 MAPK1 (0.48) DRD2DRD4DRD3KMT2AMEN1
SCHEMBL12577581 0.86 DRD2 (0.58) DRD2DRD4DRD3KMT2AMEN1
SCHEMBL12577540 0.83 METAP2 (0.52) DRD2DRD4DRD3KMT2AMEN1
SCHEMBL12640626 0.83 MEN1 (0.53) DRD2KMT2AMEN1CAMK2DMETAP2
SCHEMBL21610888 0.82 KMT2A (0.39) DRD2DRD4DRD3KMT2AMEN1
SCHEMBL12577520 0.81 SMN1; SMN2 (0.59) DRD2DRD4DRD3HTTMAPT
SCHEMBL12640625 0.80 FYN (0.53) DRD2KMT2AMEN1METAP2POLB
SCHEMBL12640588 0.78 FYN (0.49) KMT2AMEN1METAP2TMEM97SIGMAR1
SCHEMBL12640733 0.78 PDE1A (0.51) KMT2AMEN1METAP2POLBTMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3922681-A1 RED PIGMENT COMPOSITION FOR COLOR FILTER BASF SE (DE) 2021-12-15 EP disclosed
US-20210277251-A1 RED PIGMENT COMPOSITION FOR COLOR FILTER BASF SE (DE) 2021-09-09 US disclosed
US-20210277251-A1 RED PIGMENT COMPOSITION FOR COLOR FILTER BASF SE (DE) 2021-09-09 US disclosed
EP-3810696-A2 RED PIGMENT COMPOSITION FOR COLOR FILTER BASF SE (DE) 2021-04-28 EP disclosed
WO-2020002106-A2 RED PIGMENT COMPOSITION FOR COLOR FILTER BASF SE (DE) 2020-01-02 WO disclosed
WO-2020002106-A2 RED PIGMENT COMPOSITION FOR COLOR FILTER BASF SE (DE) 2020-01-02 WO disclosed