SCHEMBL1968149

SCHEMBL1968149

CCCc1cc2c(N3CCn4c(nnc4C(F)(F)F)C3)nc(Oc3ccc(CC(=O)O)cc3)nc2s1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 6/20 0.67
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
DPP4 P27487 6/20 0.33
DPP8 Q6V1X1 4/20 0.33
CYP8B1 Q9UNU6 6/20 0.33
DPP7 Q9UHL4 1/20 0.33
PPARG P37231 1/20 0.33
NR1H2 P55055 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
NR1H3 Q13133 1/20 0.33
DPP9 Q86TI2 1/20 0.33

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
SCHEMBL1968360 0.94 P2RY12 (0.65) P2RY12MEN1KMT2ADPP4DPP8
SCHEMBL1969741 0.93 P2RY12 (0.68) P2RY12MEN1KMT2ADPP4DPP8
SCHEMBL1970152 0.92 P2RY12 (0.70) P2RY12MEN1KMT2ADPP4DPP8
SCHEMBL1971072 0.92 P2RY12 (0.70) P2RY12MEN1KMT2ADPP4CYP8B1
SCHEMBL1970187 0.91 P2RY12 (0.69) P2RY12MEN1KMT2ADPP4CYP8B1
SCHEMBL1969014 0.89 P2RY12 (0.75) P2RY12MEN1KMT2ADPP4CYP8B1
SCHEMBL1966287 0.89 P2RY12 (0.66) P2RY12MEN1KMT2ADPP4CYP8B1
SCHEMBL13459805 0.89 P2RY12 (0.72) P2RY12MEN1KMT2ACYP8B1
SCHEMBL1967423 0.88 P2RY12 (0.69) P2RY12MEN1KMT2ADPP4CYP8B1
SCHEMBL1967939 0.88 P2RY12 (0.67) P2RY12MEN1KMT2ACYP8B1PPARG

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 6 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
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 127/4885MEN1 849/4885KMT2A 4236/4885

“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.