SCHEMBL3450074

SCHEMBL3450074

CCOC(=O)c1cncc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2NCc2cccnc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.51
EGFR P00533 1/20 0.43
KMT2A Q03164 1/20 0.43
NTRK1 P04629 4/20 0.43
SLC26A6 Q9BXS9 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
STK17A Q9UEE5 1/20 0.42
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
VNN1 O95497 1/20 0.42
MAP3K8 P41279 2/20 0.42
JAK2 O60674 1/20 0.41
JAK3 P52333 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK13 O15264 1/20 0.41
EIF2AK2 P19525 1/20 0.41
MAPK12 P53778 1/20 0.41

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
SCHEMBL3449932 0.93 EGFR (0.46) CSNK2A1EGFRKMT2ASTK17AABL1
SCHEMBL3451335 0.92 STK17A (0.43) CSNK2A1EGFRKMT2ANTRK1GAA
SCHEMBL13311078 0.89 CSNK2A1 (0.61) CSNK2A1NTRK1STK17AVNN1MAP3K8
SCHEMBL3448098 0.89 CSNK2A1 (0.49) CSNK2A1EGFRSTK17AMAP3K8JAK3
SCHEMBL3448109 0.87 JAK3 (0.46) EGFRNTRK1STK17AMAP3K8JAK2
SCHEMBL3448587 0.87 STK17A (0.50) CSNK2A1EGFRSTK17AAXL
SCHEMBL3448849 0.87 SYK (0.49) CSNK2A1EGFRSTK17AABL1BCR
SCHEMBL3448611 0.87 SOS1 (0.51) EGFRKMT2APOLBGAASTK17A
SCHEMBL3449761 0.86 STK17A (0.42) CSNK2A1EGFRKMT2ASTK17AAXL
SCHEMBL3448546 0.86 STK17A (0.46) CSNK2A1EGFRNTRK1STK17AABL1

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 CSNK2A1 1858/4885EGFR 2771/4885KMT2A 4408/4885

“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.