SCHEMBL3449369

SCHEMBL3449369

O=C(O)c1cc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2ccc(C(F)(F)F)n2)cnc1OCCN1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.46
EGFR P00533 9/20 0.40
JAK3 P52333 2/20 0.39
BTK Q06187 2/20 0.39
HTR2A P28223 2/20 0.39
SLC6A2 P23975 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39
SLC6A3 Q01959 1/20 0.39
PDE4D Q08499 1/20 0.39
KCNH2 Q12809 1/20 0.39
AXL P30530 1/20 0.38
FGFR1 P11362 1/20 0.38
ERBB2 P04626 1/20 0.38
BRAF P15056 1/20 0.38
MAPK14 Q16539 1/20 0.38
HTR2C P28335 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
SCHEMBL13312602 0.93 SYK (0.46) SYKEGFRAXLERBB2
SCHEMBL3450088 0.90 SYK (0.40) SYKEGFRERBB2BRAF
SCHEMBL13312778 0.89 EGFR (0.43) SYKEGFRJAK3ERBB2BRAF
SCHEMBL3448651 0.89 SYK (0.48) SYKEGFRJAK3BTKHTR2A
SCHEMBL3450103 0.87 SYK (0.41) SYKEGFRBTKAXLBRAF
SCHEMBL3449077 0.87 SYK (0.39) SYKEGFR
SCHEMBL3449232 0.87 EGFR (0.39) SYKEGFR
SCHEMBL3448208 0.85 AXL (0.42) SYKEGFRAXLERBB2
SCHEMBL3449854 0.85 SYK (0.38) SYKEGFRHTR2ASLC6A2OPRK1
SCHEMBL3451503 0.85 EGFR (0.41) SYKEGFRSLC6A3KCNH2AXL

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 804/4885EGFR 2771/4885JAK3 2419/4885

“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.