SCHEMBL3449488

SCHEMBL3449488

CCOC(=O)c1cncc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2N2CCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 11/20 0.48
PAK1 Q13153 1/20 0.46
FGFR1 P11362 2/20 0.42
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
BRD4 O60885 1/20 0.41
AXL P30530 3/20 0.41
PTK2 Q05397 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
SCHEMBL3448621 0.98 P2RY12 (0.48) P2RY12PAK1FGFR1EGFRERBB2
SCHEMBL3449923 0.98 P2RY12 (0.47) P2RY12PAK1FGFR1EGFRERBB2
SCHEMBL3448014 0.98 P2RY12 (0.47) P2RY12PAK1FGFR1EGFRERBB2
SCHEMBL3447080 0.94 PAK1 (0.53) P2RY12PAK1FGFR1EGFRBRD4
SCHEMBL3448416 0.93 P2RY12 (0.46) P2RY12PAK1FGFR1EGFRERBB2
SCHEMBL3449965 0.93 P2RY12 (0.46) P2RY12PAK1FGFR1EGFRERBB2
SCHEMBL3448122 0.93 P2RY12 (0.46) P2RY12PAK1EGFRBRD4PTK2
SCHEMBL3452344 0.92 P2RY12 (0.51) P2RY12PAK1
SCHEMBL3458418 0.91 P2RY12 (0.45) P2RY12PAK1FGFR1EGFRERBB2
SCHEMBL3449108 0.91 P2RY12 (0.46) P2RY12PAK1FGFR1BRD4AXL

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 P2RY12 2175/4885PAK1 2792/4885FGFR1 3917/4885

“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.