SCHEMBL3450458

SCHEMBL3450458

CC1CCCN1c1nc(Nc2ccc(F)c(Cl)c2)ncc1-c1cncc(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.48
JAK3 P52333 1/20 0.48
CSNK2A1 P68400 6/20 0.44
EGFR P00533 2/20 0.41
XDH P47989 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
GRM5 P41594 1/20 0.39
CSNK2A2 P19784 2/20 0.39
CSNK2B P67870 2/20 0.39
NTRK1 P04629 5/20 0.39
AXL P30530 2/20 0.38

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
SCHEMBL3448430 0.89 LCK (0.45) LCKJAK3CSNK2A1EGFRAXL
SCHEMBL3447604 0.88 CSNK2A1 (0.43) CSNK2A1EGFRXDHSLC22A12CSNK2A2
SCHEMBL3449234 0.86 XDH (0.43) LCKJAK3CSNK2A1EGFRXDH
SCHEMBL3447674 0.86 JAK3 (0.43) LCKJAK3CSNK2A1EGFRXDH
SCHEMBL3449527 0.85 CSNK2A1 (0.43) CSNK2A1EGFRXDHSLC22A12CSNK2A2
SCHEMBL3448886 0.85 KIT (0.43) LCKJAK3CSNK2A1EGFRXDH
SCHEMBL3447741 0.85 JAK3 (0.44) LCKJAK3CSNK2A1EGFRXDH
SCHEMBL3451174 0.85 JAK3 (0.44) LCKJAK3CSNK2A1EGFRXDH
SCHEMBL3449427 0.83 AXL (0.50) CSNK2A1EGFRXDHSLC22A12AXL
SCHEMBL3450574 0.83 F11 (0.44) CSNK2A1EGFRXDHSLC22A12

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 LCK 1761/4885JAK3 2419/4885CSNK2A1 1858/4885

“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.