SCHEMBL5532492

SCHEMBL5532492

C(=C/c1ccnc(-c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccn2)c1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 11/20 0.48
HDAC1 Q13547 8/20 0.43
HDAC6 Q9UBN7 7/20 0.43
HDAC2 Q92769 2/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
APP P05067 1/20 0.43
RELA Q04206 2/20 0.42
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
ALOX15 P16050 1/20 0.40
CASP1 P29466 1/20 0.40
RAB9A P51151 1/20 0.40
HBB P68871 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
S100A4 P26447 1/20 0.39
KDM4E B2RXH2 2/20 0.37

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
SCHEMBL5532497 1.00 KDM1A (0.48) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL14599359 0.95 KDM1A (0.45) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL14599371 0.94 KDM1A (0.44) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL14599358 0.91 KDM1A (0.42) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL14599363 0.91 KDM1A (0.42) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL21173781 0.89 KDM1A (0.41) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL14599361 0.87 KDR (0.40) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL12256866 0.85 KDM1A (0.52) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL29905760 0.84 KDM1A (0.53) KDM1AHDAC1HDAC6HDAC2MAOA
SCHEMBL7967117 0.84 KDM1A (0.53) KDM1AHDAC1HDAC6HDAC2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070017569-A1 Metal complex compositions and use thereof in dye sensitized solar cells GENERAL ELECTRIC COMPANY 2007-01-25 US disclosed
US-20070017569-A1 Metal complex compositions and use thereof in dye sensitized solar cells GENERAL ELECTRIC COMPANY 2007-01-25 US disclosed
US-20070017569-A1 Metal complex compositions and use thereof in dye sensitized solar cells GENERAL ELECTRIC COMPANY 2007-01-25 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-20070017569-A1 Metal complex compositions and use thereof in dye sensitized solar cells TST, SPR, TYR KDM1A 2589/4885HDAC1 1661/4885HDAC6 3546/4885

“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.