SCHEMBL12413189

SCHEMBL12413189

Cc1ccc2c3sc4cc5c(cc4c3n(C)c2c1)sc1c2ccc(C)cc2n(C)c51

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.35
MAPT P10636 4/20 0.35
KDM4E B2RXH2 3/20 0.35
MCL1 Q07820 2/20 0.35
RAB9A P51151 2/20 0.35
HTT P42858 2/20 0.35
APAF1 O14727 1/20 0.35
IDO1 P14902 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SRC P12931 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34
PARP15 Q460N3 3/20 0.33
PARP10 Q53GL7 3/20 0.33
TNKS2 Q9H2K2 3/20 0.33
PARP2 Q9UGN5 3/20 0.33
CYP2A6 P11509 2/20 0.33
BCL2L1 Q07817 1/20 0.33
PKLR P30613 2/20 0.33

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
SCHEMBL17281047 0.93 MCL1 (0.36) PKMMAPTKDM4EMCL1RAB9A
SCHEMBL12412978 0.89 PKM (0.33) PKMMAPTKDM4EMCL1RAB9A
SCHEMBL12413187 0.88 MCL1 (0.37) PKMMAPTKDM4EMCL1RAB9A
SCHEMBL17281048 0.86 TP53 (0.43) MAPTKDM4ERAB9ATDP1SRC
SCHEMBL12412980 0.83 MCL1 (0.38) PKMMAPTKDM4EMCL1RAB9A
SCHEMBL12412959 0.83 PKM (0.37) PKMMAPTKDM4EMCL1RAB9A
SCHEMBL17281053 0.81 MAOB (0.39) PKMPKLRMAOA
SCHEMBL12413057 0.81 MCL1 (0.33) PKMMAPTKDM4EMCL1RAB9A
SCHEMBL12412936 0.80 HTT (0.35) MAPTKDM4EMCL1RAB9AHTT
SCHEMBL12412979 0.79 ALDH1A1 (0.33) PKMMAPTKDM4EMCL1RAB9A

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-20110166362-A1 NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-07 US disclosed
US-20110166362-A1 NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-07 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-20110166362-A1 NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL SCLY, MSRB3, SOD1 PKM 4352/4885MAPT 4576/4885KDM4E 1286/4885

“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.