SCHEMBL3449602

SCHEMBL3449602

NC(=O)c1cc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2ccc(C(F)(F)F)n2)ccn1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.41
TGFBR1 P36897 1/20 0.40
MAPK1 P28482 1/20 0.38
ULK1 O75385 1/20 0.38
STK17A Q9UEE5 2/20 0.37
STK17B O94768 1/20 0.37
CSNK1A1 P48729 1/20 0.37
KIT P10721 2/20 0.37
FLT3 P36888 2/20 0.37
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GRM2 Q14416 1/20 0.36
TDO2 P48775 1/20 0.36
JAK3 P52333 1/20 0.36
IDH1 O75874 1/20 0.36

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
SCHEMBL3375503 0.93 SYK (0.40) SYKMAPK1ULK1MAPTNPSR1
SCHEMBL3374098 0.91 MAPT (0.40) SYKMAPK1ULK1CSNK1A1MAPT
SCHEMBL3448235 0.89 SYK (0.49) SYKTGFBR1CSNK1A1MAPTNPSR1
SCHEMBL3450069 0.88 SYK (0.42) SYKMAPK1ULK1STK17ASTK17B
SCHEMBL3452335 0.86 IDH1 (0.47) SYKTGFBR1MAPK1ULK1STK17A
SCHEMBL3451973 0.85 CSF1R (0.44) SYKKITFLT3
SCHEMBL3449322 0.85 MAPK1 (0.47) SYKMAPK1ULK1STK17ASTK17B
SCHEMBL3451173 0.85 CSF1R (0.42) SYKSTK17ASTK17BKITFLT3
SCHEMBL3374672 0.85 SYK (0.48) SYKMAPTNPSR1
SCHEMBL3449213 0.84 SYK (0.41) SYKMAPK1ULK1STK17ASTK17B

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 804/4885TGFBR1 4416/4885MAPK1 2905/4885

“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.