SCHEMBL3449277

SCHEMBL3449277

CCOC(=O)c1cncc(-c2cnc(Nc3cccc(C#N)c3)nc2-n2nc(C(F)(F)F)cc2C)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.48
CNR2 P34972 1/20 0.40
P2RY12 Q9H244 1/20 0.40
KDM4E B2RXH2 2/20 0.39
MAPT P10636 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
UBA2 Q9UBT2 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FGFR1 P11362 1/20 0.37
EGFR P00533 1/20 0.37
BTK Q06187 1/20 0.37
MAOB P27338 1/20 0.37
GRM5 P41594 1/20 0.37
VNN1 O95497 1/20 0.37
PTK2 Q05397 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
SCHEMBL3448843 0.91 SYK (0.43) SYKKDM4EMAPTSAE1UBA2
SCHEMBL3449237 0.91 SYK (0.51) SYKP2RY12KDM4ENPC1RAB9A
SCHEMBL3449440 0.91 SYK (0.47) SYKCNR2EGFRBTKMAOB
SCHEMBL3449422 0.90 SYK (0.39) SYKKDM4EMAPTSAE1UBA2
SCHEMBL3450037 0.90 SYK (0.52) SYKKDM4EMAPTNPC1RAB9A
SCHEMBL3450300 0.90 SYK (0.50) SYKCNR2KDM4EMAPTNPC1
SCHEMBL13311816 0.90 SYK (0.49) SYKKDM4EMAPTNPC1RAB9A
SCHEMBL3447149 0.90 SYK (0.39) SYKCNR2P2RY12KDM4EMAPT
SCHEMBL3449523 0.89 SYK (0.49) SYKCNR2P2RY12KDM4EMAPT
SCHEMBL3375394 0.89 MAPT (0.41) SYKP2RY12KDM4EMAPTSAE1

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 2 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

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 804/4885CNR2 517/4885P2RY12 2175/4885

“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.