SCHEMBL1966323

SCHEMBL1966323

CCCc1cc2c(N3CCn4c(nnc4C(F)(F)C(F)(F)F)C3)nc(N3CCN(C(=O)OC(C)(C)C)CC3)nc2s1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 12/20 0.55
TLR9 Q9NR96 2/20 0.38
TLR7 Q9NYK1 1/20 0.38
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
DPP4 P27487 2/20 0.35
SLC2A1 P11166 1/20 0.35
DPP8 Q6V1X1 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
PIK3CA P42336 1/20 0.34
GBA1 P04062 1/20 0.34

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
SCHEMBL1970448 0.94 P2RY12 (0.62) P2RY12TLR9TLR7MEN1KMT2A
SCHEMBL12491455 0.90 P2RY12 (0.54) P2RY12MEN1KMT2ADPP4DPP8
SCHEMBL1966727 0.88 P2RY12 (0.54) P2RY12TLR9TLR7MEN1KMT2A
SCHEMBL1968416 0.86 P2RY12 (0.64) P2RY12MEN1KMT2A
SCHEMBL1967555 0.86 P2RY12 (0.60) P2RY12MEN1KMT2ADPP4PIK3CA
SCHEMBL1967888 0.84 P2RY12 (0.59) P2RY12MEN1KMT2ADPP4
SCHEMBL1968547 0.84 P2RY12 (0.64) P2RY12MEN1KMT2ADPP4
SCHEMBL12490336 0.84 P2RY12 (0.61) P2RY12MEN1KMT2A
SCHEMBL1971209 0.83 P2RY12 (0.64) P2RY12MEN1KMT2ADPP4DPP8
SCHEMBL1969407 0.83 P2RY12 (0.66) P2RY12MEN1KMT2ADPP4DPP8

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110166121-A1 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2011-07-07 US disclosed
US-20110166121-A1 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2011-07-07 US disclosed
EP-2334689-A2 FUSED HETEROCYCLIC COMPOUND LG Life Sciences Ltd. (KR) 2011-06-22 EP disclosed
WO-2010027236-A2 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2010-03-11 WO disclosed
WO-2010027236-A2 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2010-03-11 WO 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-20110166121-A1 FUSED HETEROCYCLIC COMPOUND F2, PF4, F11 P2RY12 127/4885TLR9 4775/4885TLR7 4777/4885

“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.