SCHEMBL1531749

SCHEMBL1531749

O=C(O)C(CC1CC1)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRN P28799 6/20 0.65
SORT1 Q99523 6/20 0.65
GRM4 Q14833 4/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.39
CCKBR P32239 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL1531745 1.00 GRN (0.65) GRNSORT1GRM4MEN1KMT2A
SCHEMBL24283494 0.79 GRN (1.00) GRNSORT1CCKBR
SCHEMBL1531545 0.77 GRN (0.46) GRNSORT1MEN1KMT2AGAA
SCHEMBL1531548 0.77 GRN (0.46) GRNSORT1MEN1KMT2AGAA
SCHEMBL8785420 0.77 GRN (0.44) GRNSORT1MEN1KMT2AGAA
SCHEMBL26117911 0.75 GRN (0.43) GRNSORT1
SCHEMBL12409431 0.75 GRN (0.43) GRNSORT1MEN1KMT2AGAA
SCHEMBL26117907 0.75 GRN (0.43) GRNSORT1
SCHEMBL1644456 0.74 GRN (0.44) GRNSORT1GAA
SCHEMBL1644455 0.74 GRN (0.44) GRNSORT1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9029359-B2 Heteroaryl Btk inhibitors BIOGEN IDEC MA, INC. (US) 2015-05-12 US disclosed
EP-2485589-A1 HETEROARYL BTK INHIBITORS Biogen Idec MA Inc. (US) 2012-08-15 EP disclosed
US-20120157442-A1 HETEROARYL BTK INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2012-06-21 US disclosed
WO-2011029043-A1 HETEROARYL BTK INHIBITORS BIOGEN IDEC MA INC. (US) 2011-03-10 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-20120157442-A1 HETEROARYL BTK INHIBITORS BTK, LYN, SYK GRN 4415/4885SORT1 4585/4885GRM4 4607/4885

“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.