SCHEMBL3449663

SCHEMBL3449663

CCOC(=O)c1cncc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2cnc(C(F)(F)F)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.44
EGFR P00533 3/20 0.40
ERBB2 P04626 1/20 0.40
FGFR1 P11362 2/20 0.39
P2RY12 Q9H244 3/20 0.38
PAK1 Q13153 1/20 0.38
STK17A Q9UEE5 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
AXL P30530 1/20 0.35
CSNK2A1 P68400 1/20 0.35
RXFP1 Q9HBX9 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
SCHEMBL3452230 0.89 XDH (0.40) SYKEGFRCSNK2A1
SCHEMBL3450169 0.88 SYK (0.44) SYKEGFRERBB2FGFR1P2RY12
SCHEMBL3435889 0.87 FGFR1 (0.44) SYKEGFRERBB2FGFR1P2RY12
SCHEMBL3448702 0.87 SYK (0.44) SYKEGFRERBB2FGFR1P2RY12
SCHEMBL3451837 0.85 FGFR1 (0.42) SYKEGFRERBB2FGFR1P2RY12
SCHEMBL3449393 0.84 EGFR (0.44) SYKEGFRERBB2FGFR1P2RY12
SCHEMBL3448523 0.84 P2RY12 (0.43) SYKEGFRERBB2FGFR1P2RY12
SCHEMBL3376192 0.83 FGFR1 (0.42) SYKEGFRERBB2FGFR1P2RY12
SCHEMBL3448621 0.83 P2RY12 (0.48) EGFRERBB2FGFR1P2RY12PAK1
SCHEMBL3449488 0.83 P2RY12 (0.48) EGFRERBB2FGFR1P2RY12PAK1

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 4 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
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 WO 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 2771/4885ERBB2 2537/4885

“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.