SCHEMBL12640646

SCHEMBL12640646

Cc1ccc(C2=C3C(=O)NC(c4ccc(C(=O)NCCCN(C)C)cc4)=C3C(=O)N2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.52
MAPK14 Q16539 1/20 0.48
PDE1A P54750 1/20 0.47
PDE1B Q01064 1/20 0.47
PDE4D Q08499 1/20 0.47
PDE7A Q13946 1/20 0.47
PDE1C Q14123 1/20 0.47
PDE3A Q14432 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 5/20 0.45
POLB P06746 4/20 0.45
ALDH1A1 P00352 3/20 0.45
HTT P42858 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
AGTR1 P30556 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL12577672 0.90 HPGD (0.57) HPGDMAPK14PDE1APDE1BPDE4D
SCHEMBL24061013 0.85 HPGD (0.65) HPGDMAPK14L3MBTL1KDM4EPOLB
SCHEMBL2120449 0.83 HPGD (0.70) HPGDMAPK14L3MBTL1KDM4EPOLB
SCHEMBL12577540 0.81 METAP2 (0.52) HPGDPDE1APDE1BPDE4DPDE7A
SCHEMBL12640625 0.81 FYN (0.53) HPGDPDE1APDE1BPDE4DPDE7A
SCHEMBL12577521 0.81 L3MBTL1 (0.51) L3MBTL1ALDH1A1HTTSMN1; SMN2NPC1
SCHEMBL12640626 0.81 MEN1 (0.53) HPGDPDE1APDE1BPDE4DPDE7A
SCHEMBL12640588 0.80 FYN (0.49) HPGDMAPK14PDE1APDE1BPDE4D
SCHEMBL12640733 0.80 PDE1A (0.51) HPGDPDE1APDE1BPDE4DPDE7A
SCHEMBL12577581 0.80 DRD2 (0.58) ALDH1A1MEN1KMT2ALMNAACKR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8273269-B2 Red colour filter composition BASF SE (DE) 2012-09-25 US disclosed
US-20110155973-A1 IMPROVED, RED COLOUR FILTER COMPOSITION BASF SE (DE) 2011-06-30 US 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-20110155973-A1 IMPROVED, RED COLOUR FILTER COMPOSITION NR2E3, MRPS22, NR2C2 HPGD 2964/4885MAPK14 3074/4885PDE1A 4763/4885

“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.