SCHEMBL3449587

SCHEMBL3449587

O=C(O)C=Cc1cccc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2nc(C(F)(F)F)cc2C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.36
CSNK1A1 P48729 1/20 0.36
ORAI1 Q96D31 2/20 0.35
TRPC1 P48995 1/20 0.35
TRPC3 Q13507 1/20 0.35
STIM1 Q13586 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
AURKA O14965 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
RHOA P61586 1/20 0.35
ULK1 O75385 1/20 0.34
EGFR P00533 2/20 0.34
CTSC P53634 2/20 0.34
TRPV1 Q8NER1 1/20 0.33

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
SCHEMBL3449584 1.00 SYK (0.36) SYKCSNK1A1ORAI1TRPC1TRPC3
SCHEMBL3447647 0.92 SYK (0.37) SYKCSNK1A1PIM2AURKAGSK3A
SCHEMBL3447650 0.92 SYK (0.37) SYKCSNK1A1PIM2AURKAGSK3A
SCHEMBL3448630 0.87 MAPT (0.37) SYKCSNK1A1PIM2AURKAGSK3A
SCHEMBL3448633 0.87 MAPT (0.37) SYKCSNK1A1PIM2AURKAGSK3A
SCHEMBL3448103 0.86 SYK (0.37) SYKCSNK1A1PIM2AURKAGSK3A
SCHEMBL3448111 0.86 SYK (0.37) SYKCSNK1A1PIM2AURKAGSK3A
SCHEMBL3447185 0.85 KCNN3 (0.42) SYKCSNK1A1PIM2AURKAGSK3A
SCHEMBL3447183 0.85 KCNN3 (0.42) SYKCSNK1A1PIM2AURKAGSK3A
SCHEMBL3448515 0.84 PIM2 (0.40) CSNK1A1PIM2AURKAGSK3AGSK3B

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 1 patent. 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

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 804/4885CSNK1A1 1378/4885ORAI1 3158/4885

“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.