SCHEMBL3449263

SCHEMBL3449263

Cc1cc(C(F)(F)F)nn1-c1nc(Nc2cccc(C#N)c2)ncc1-c1cccc(C=CC(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SYK P43405 12/20 0.42
CNR2 P34972 1/20 0.41
EGFR P00533 1/20 0.38
BTK Q06187 1/20 0.38
MAOB P27338 1/20 0.38
GRM5 P41594 1/20 0.38
P4HB P07237 1/20 0.37
RHOA P61586 1/20 0.36
PTK2 Q05397 1/20 0.36

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
SCHEMBL3449260 1.00 SYK (0.42) SYKCNR2EGFRBTKMAOB
SCHEMBL3451731 0.92 IDH1 (0.39) SYKCNR2GRM5
SCHEMBL3451737 0.92 IDH1 (0.39) SYKCNR2GRM5
SCHEMBL3448270 0.90 SYK (0.37) SYKCNR2EGFRBTK
SCHEMBL3448273 0.90 SYK (0.37) SYKCNR2EGFRBTK
SCHEMBL3450798 0.90 SYK (0.41) SYKGRM5RHOA
SCHEMBL3450796 0.90 SYK (0.41) SYKGRM5RHOA
SCHEMBL3449941 0.90 SYK (0.41) SYKCNR2BTKMAOBGRM5
SCHEMBL3449936 0.90 SYK (0.41) SYKCNR2BTKMAOBGRM5
SCHEMBL3451479 0.89 SYK (0.47) SYKRHOAPTK2

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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD SYK 804/4885CNR2 517/4885EGFR 2771/4885

“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.