SCHEMBL12106904

SCHEMBL12106904

CCN(CC)c1ccc(N=C2C=C(NC(=O)C(C)C)C(=O)C(Cl)=C2C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.41
MAPT P10636 8/20 0.36
ALDH1A1 P00352 7/20 0.36
MEN1 O00255 7/20 0.36
KMT2A Q03164 7/20 0.36
KDM4E B2RXH2 4/20 0.36
HPGD P15428 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MCL1 Q07820 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
THRB P10828 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 2/20 0.35
NOX1 Q9Y5S8 2/20 0.33
TSHR P16473 1/20 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
SCHEMBL12106921 0.88 ALDH1A1 (0.38) CNR2MAPTALDH1A1MEN1KMT2A
SCHEMBL12106917 0.87 MAPT (0.36) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL92428 0.85 MAPT (0.39) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL12106903 0.85 HDAC3 (0.37) CNR2MAPTALDH1A1MEN1KMT2A
SCHEMBL12106922 0.85 CNR2 (0.40) CNR2MAPTALDH1A1MEN1KMT2A
SCHEMBL14157756 0.84 ESRRG (0.43) CNR2MAPTALDH1A1MEN1KMT2A
SCHEMBL12106906 0.82 GHSR (0.36) CNR2MAPTALDH1A1MEN1KMT2A
SCHEMBL92900 0.82 RAB9A (0.35) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL12106911 0.82 GHSR (0.36) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL12106907 0.81 MAPT (0.32) CNR2MAPTALDH1A1MEN1KMT2A

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-8052785-B2 Polymer containing image receiver sheet on support FUJIFILM CORPORATION (JP) 2011-11-08 US disclosed
US-20080242542-A1 INDANILINE DYE, THERMAL TRANSFER RECORDING INK SHEET, THERMAL TRANSFER RECORDING METHOD, COLOR TONER, INKJET INK, AND COLOR FILTER FUJIFILM CORPORATION (JP) 2008-10-02 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-20080242542-A1 INDANILINE DYE, THERMAL TRANSFER RECORDING INK SHEET, THERMAL TRANSFER RECORDING METHOD, COLOR TONER, INKJET INK, AND COLOR FILTER INMT, TYR, IK CNR2 3021/4885MAPT 389/4885ALDH1A1 401/4885

“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.