SCHEMBL3452293

SCHEMBL3452293

CS(=O)(=O)c1cc(Nc2ncc(-c3cccc(/C=C/C(=O)O)c3)c(-n3ccc(C(F)(F)F)n3)n2)ccc1F

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.36
PIM2 Q9P1W9 1/20 0.34
RHOA P61586 1/20 0.33
GPER1 Q99527 1/20 0.33
FYN P06241 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
JAK2 O60674 1/20 0.32
BRD4 O60885 1/20 0.32
JAK1 P23458 1/20 0.32
BRD2 P25440 1/20 0.32
JAK3 P52333 1/20 0.32
BRD3 Q15059 1/20 0.32
BRDT Q58F21 1/20 0.32

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
SCHEMBL3452294 1.00 SYK (0.36) SYKPIM2RHOAGPER1FYN
SCHEMBL3450050 0.90 SYK (0.45) SYKRHOAJAK2JAK3
SCHEMBL3450054 0.90 SYK (0.45) SYKRHOAJAK2JAK3
SCHEMBL3448630 0.88 MAPT (0.37) SYKPIM2RHOAFYN
SCHEMBL3448633 0.88 MAPT (0.37) SYKPIM2RHOAFYN
SCHEMBL3448099 0.87 MAOB (0.40) SYKPIM2RHOAFYN
SCHEMBL3448101 0.87 MAOB (0.40) SYKPIM2RHOAFYN
SCHEMBL3451242 0.86 SYK (0.41) SYKPIM2RHOA
SCHEMBL3451237 0.86 SYK (0.41) SYKPIM2RHOA
SCHEMBL3450407 0.86 IDH1 (0.42) SYKPIM2RHOAFYN

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 3 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
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 804/4885PIM2 3060/4885RHOA 2069/4885

“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.