SCHEMBL2633037

SCHEMBL2633037

CC(=O)O[C@H]1C=COCC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.36
CA9 Q16790 4/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CHRM2 P08172 3/20 0.34
MEN1 O00255 1/20 0.34
CYP2D6 P10635 1/20 0.34
KMT2A Q03164 1/20 0.34
CHRM1 P11229 1/20 0.34
TSHR P16473 1/20 0.31

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
SCHEMBL14568395 1.00 CA12 (0.36) CA12CA9CA1CA2CHRM2
SCHEMBL27934891 1.00 CA12 (0.36) CA12CA9CA1CA2CHRM2
SCHEMBL18487527 0.78 RECQL (0.31)
SCHEMBL8354298 0.77 CA12 (0.42) CA12CA9CA1CA2CHRM2
SCHEMBL942938 0.77 CA12 (0.42) CA12CA9CA1CA2CHRM2
SCHEMBL17696628 0.73 CA12 (0.33) CA12CA9CA1CA2CHRM2
SCHEMBL5492216 0.73
SCHEMBL2541143 0.73 CA12 (0.40) CA12CA9CA1CA2CHRM2
SCHEMBL2541139 0.73 CA12 (0.40) CA12CA9CA1CA2CHRM2
SCHEMBL11414567 0.71 CA12 (0.41) CA12CA9CA1CA2CHRM2

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-8349860-B2 Inhibitors of syk and JAK protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2013-01-08 US disclosed
US-20120101275-A1 INHIBITORS OF SYK AND JAK PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2012-04-26 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-20120101275-A1 INHIBITORS OF SYK AND JAK PROTEIN KINASES SYK, BTK, JAK1 CA12 4660/4885CA9 4026/4885CA1 3922/4885

“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.