SCHEMBL3454800

SCHEMBL3454800

Cc1cc(C(F)(F)F)nn1-c1nc(Nc2ccc(F)c(Cl)c2)ncc1-c1cc(C(=O)O)c(=O)n(CCN2CCOCC2)c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.42
RAF1 P04049 2/20 0.37
BRAF P15056 2/20 0.37
AVPR1B P47901 3/20 0.36
EGFR P00533 7/20 0.36
AXL P30530 2/20 0.36
CASP3 P42574 1/20 0.36
KDR P35968 1/20 0.36
MAP3K8 P41279 2/20 0.35
ERBB2 P04626 1/20 0.35
ERBB4 Q15303 1/20 0.35
WEE1 P30291 1/20 0.35

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
SCHEMBL3448462 0.94 SYK (0.38) SYKRAF1BRAFAVPR1BEGFR
SCHEMBL3448330 0.92 AXL (0.36) SYKEGFRAXL
SCHEMBL3448963 0.90 SYK (0.36) SYKRAF1BRAFEGFRAXL
SCHEMBL3448714 0.90 SYK (0.38) SYKEGFRAXL
SCHEMBL3448651 0.89 SYK (0.48) SYKEGFRAXL
SCHEMBL3450088 0.89 SYK (0.40) SYKBRAFEGFRKDRMAP3K8
SCHEMBL3449131 0.89 SYK (0.37) SYKEGFRAXL
SCHEMBL3447298 0.88 RAF1 (0.38) SYKRAF1BRAFEGFRAXL
SCHEMBL3449285 0.88 EGFR (0.42) SYKBRAFEGFRAXLKDR
SCHEMBL3456772 0.87 SYK (0.38) SYKEGFRAXLWEE1

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 804/4885RAF1 2448/4885BRAF 1251/4885

“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.