SCHEMBL3449232

SCHEMBL3449232

O=C(O)c1cc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2ccc(C(F)(F)F)n2)cnc1OCCn1ccnc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.39
ABL1 P00519 1/20 0.37
BCR P11274 1/20 0.37
SRC P12931 1/20 0.37
PRKCA P17252 1/20 0.37
PRKCD Q05655 1/20 0.37
SYK P43405 9/20 0.37
ITK Q08881 1/20 0.36
XDH P47989 1/20 0.33
SLC22A12 Q96S37 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
SCHEMBL3374382 0.93 EGFR (0.41) EGFRABL1BCRSRCPRKCA
SCHEMBL3449502 0.89 EGFR (0.39) EGFRABL1BCRSRCPRKCA
SCHEMBL13312430 0.89 SYK (0.38) SYKXDHSLC22A12
SCHEMBL3450103 0.88 SYK (0.41) EGFRSYKITK
SCHEMBL3457053 0.88 EGFR (0.39) EGFRABL1BCRSRCPRKCA
SCHEMBL3449077 0.88 SYK (0.39) EGFRSYKXDHSLC22A12
SCHEMBL13312602 0.87 SYK (0.46) EGFRSYK
SCHEMBL3449369 0.87 SYK (0.46) EGFRSYK
SCHEMBL3448901 0.86 EGFR (0.41) EGFRABL1SRCSYKXDH
SCHEMBL13312614 0.85 SYK (0.35) EGFRSYKITK

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 EGFR 2771/4885ABL1 370/4885BCR 3224/4885

“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.