SCHEMBL7203713

SCHEMBL7203713

CC(=O)c1cscc1C1=CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.37
PTGS2 P35354 1/20 0.35
PSMB5 P28074 6/20 0.35
PSMB1 P20618 1/20 0.35
CLCN2 P51788 1/20 0.34
HDAC4 P56524 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
GRM2 Q14416 2/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
JAK2 O60674 1/20 0.30
JAK3 P52333 1/20 0.30
CSF1R P07333 1/20 0.30

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
SCHEMBL2744834 0.78 PSMB5 (0.40) ACMSDPTGS2PSMB5PSMB1CCNE1
SCHEMBL30657553 0.75 PTGS2 (0.49) ACMSDPTGS2PSMB5CLCN2GRM2
SCHEMBL27173426 0.74 PSMB5 (0.45) PTGS2PSMB5PSMB1CCNE1CDK2
SCHEMBL2744786 0.72 PSMB5 (0.34) ACMSDPTGS2PSMB5PSMB1GRM2
SCHEMBL7209639 0.70 PSMB5 (0.38) PTGS2PSMB5PSMB1CCNE1CDK2
SCHEMBL15287144 0.67 F2RL1 (0.44) ACMSDCLCN2HDAC2GRM2
SCHEMBL3092798 0.66 CSF1R (0.41) ACMSDPTGS2PSMB5HDAC2GRM2
SCHEMBL11816684 0.66 ACMSD (0.51) ACMSDPTGS2HDAC2KMT2A
SCHEMBL3092807 0.65 HDAC1 (0.43) ACMSDHDAC2CSF1R
SCHEMBL11673820 0.65 ACMSD (0.50) ACMSDPTGS2HDAC2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1274706-A1 PYRAZOLES FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2003-01-15 EP disclosed
US-6462069-B2 KINASE INHIBITORS; ANTICANCER AGENTS AGOURON PHARMACEUTICALS, INC. 2002-10-08 US disclosed
WO-2001079198-A9 PYRAZOLES FOR INHIBITING PROTEIN KINASE AGOURON PHARMA (US) 2002-05-16 WO disclosed
US-20020006952-A1 Compounds, pharmaceutical compositions, and methods for inhibiting protein kinases LIGHPOINTE COMMUNICATION, INC. 2002-01-17 US disclosed
WO-2001079198-A1 PYRAZOLES FOR INHIBITING PROTEIN KINASE AGOURON PHARMACEUTICALS, INC. (US) 2001-10-25 WO 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-20020006952-A1 Compounds, pharmaceutical compositions, and methods for inhibiting protein kinases CDK3, CCNK, CDK1 ACMSD 4464/4885PTGS2 397/4885PSMB5 1423/4885

“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.