SCHEMBL10288652

SCHEMBL10288652

CC(C)(C)CNC(=O)COCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 2/20 0.45
ADORA3 P0DMS8 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
PTPRC P08575 1/20 0.45
PTPN1 P18031 1/20 0.45
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
FKBP1A P62942 1/20 0.44
NAMPT P43490 1/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
GRM5 P41594 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 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
SCHEMBL27450929 0.88 CSNK1D (0.46) CSNK1DADORA3ADORA2AADORA1PTPRC
SCHEMBL21015988 0.85 HPGD (0.44) CSNK1DADORA3ADORA2AADORA1PTPRC
SCHEMBL30595231 0.84 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2FKBP1AKMT2AMEN1
SCHEMBL30241741 0.84 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2FKBP1AKMT2AMEN1
SCHEMBL19169195 0.82 POLB (0.44) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL12561178 0.82 SMN1; SMN2 (0.54) CSNK1DADORA3ADORA2AADORA1PTPRC
SCHEMBL30241751 0.82 LMNA (0.45) ALDH1A1SMN1; SMN2FKBP1AKMT2AKDM4E
SCHEMBL21015915 0.81 HPGD (0.45) ALDH1A1NAMPTKMT2AKDM4EMEN1
SCHEMBL12376667 0.81 MAPT (0.55) CSNK1DADORA3ADORA2AADORA1PTPRC
SCHEMBL21015656 0.80 TRPV1 (0.46) ALDH1A1NAMPTKMT2AKDM4EMAPT

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-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 US disclosed
US-20080064718-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2008-03-13 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 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 (2 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-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 CSNK1D 2366/4885ADORA3 1455/4885ADORA2A 1290/4885
US-20080064718-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET CSNK1D 912/4885ADORA3 3052/4885ADORA2A 2939/4885

“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.