SCHEMBL21609758

SCHEMBL21609758

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.48
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 2/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 2/20 0.43
TSHR P16473 1/20 0.43
TMEM97 Q5BJF2 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
PDE1A P54750 1/20 0.42
PDE1B Q01064 1/20 0.42
PDE4D Q08499 1/20 0.42
PDE7A Q13946 1/20 0.42
PDE1C Q14123 1/20 0.42
PDE3A Q14432 1/20 0.42

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
SCHEMBL30038995 1.00 MAPK1 (0.48) MAPK1ALDH1A1KDM4EHSD17B10LMNA
SCHEMBL12640733 0.90 PDE1A (0.51) ALDH1A1KDM4EHSD17B10POLBHPGD
SCHEMBL12577562 0.89 SMN1; SMN2 (0.54) PIM1PIM2SMN1; SMN2TP53GAA
SCHEMBL21609759 0.87 DRD2 (0.43) MAPK1ALDH1A1LMNAPOLBHPGD
SCHEMBL12577581 0.85 DRD2 (0.58) MAPK1ALDH1A1LMNAKMT2AMEN1
SCHEMBL12640625 0.82 FYN (0.53) ALDH1A1KDM4EHSD17B10POLBHPGD
SCHEMBL12577540 0.82 METAP2 (0.52) ALDH1A1KDM4EHSD17B10HPGDKMT2A
SCHEMBL12640626 0.82 MEN1 (0.53) ALDH1A1KDM4EHSD17B10HPGDKMT2A
SCHEMBL12577569 0.82 SMN1; SMN2 (0.55) KMT2AMEN1TMEM97SIGMAR1PIM1
SCHEMBL12640588 0.80 FYN (0.49) MAPK1ALDH1A1KDM4EHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112313290-B Red pigment composition for color filter 太阳化学有限公司 2022-11-04 CN 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
CN-112313290-A Red pigment composition for color filter 巴斯夫欧洲公司 2021-02-02 CN disclosed
WO-2020002106-A2 RED PIGMENT COMPOSITION FOR COLOR FILTER BASF SE (DE) 2020-01-02 WO disclosed