SCHEMBL3374292

SCHEMBL3374292

COC(=O)c1cc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2ccc(C(F)(F)F)n2)cnc1OC(C)c1ccncc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.36
SCN9A Q15858 2/20 0.36
TGFBR1 P36897 1/20 0.35
RORC P51449 1/20 0.34
SYK P43405 3/20 0.34
BRAF P15056 2/20 0.34
EGFR P00533 2/20 0.33
IDH1 O75874 2/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
WDR5 P61964 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
SCHEMBL3451210 0.94 SYK (0.37) SCN9ARORCSYKBRAFEGFR
SCHEMBL3376401 0.89 CSNK2A1 (0.36) CSNK2A1SCN9ATGFBR1RORCSYK
SCHEMBL3378656 0.88 PTK2 (0.37) CSNK2A1SYKEGFRABL1BCR
SCHEMBL13312593 0.85 SYK (0.38) SYKEGFRIDH1
SCHEMBL3449292 0.85 NTRK1 (0.39) CSNK2A1SYK
SCHEMBL3448928 0.85 P2RX3 (0.40) SYKEGFR
SCHEMBL3448766 0.84 EGFR (0.38) SYKEGFR
SCHEMBL3374382 0.84 EGFR (0.41) CSNK2A1SYKEGFRABL1BCR
SCHEMBL13420855 0.84 SYK (0.34) CSNK2A1SCN9ATGFBR1SYKEGFR
SCHEMBL3450639 0.83 CSNK2A1 (0.36) CSNK2A1SYKEGFRABL1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820673-B2 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 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
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
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 WO disclosed
US-20070093501-A1 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-26 US disclosed
EP-1695961-A1 UREA DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2006-08-30 EP 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 (2 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 CSNK2A1 1858/4885SCN9A 3206/4885TGFBR1 4416/4885
US-20070093501-A1 Urea derivative, process for producing the same, and use F2, URB2, F12 CSNK2A1 1893/4885SCN9A 955/4885TGFBR1 1545/4885

“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.