SCHEMBL1967657

SCHEMBL1967657

CC1CCNC1.CCCc1cc2c(N3CCn4c(nnc4C(F)(F)F)C3)nc(N)nc2s1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.61
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP8B1 Q9UNU6 11/20 0.32
DPP4 P27487 3/20 0.31
DPP8 Q6V1X1 2/20 0.31
DPP9 Q86TI2 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
HTR6 P50406 1/20 0.31
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30

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
SCHEMBL1969098 0.90 P2RY12 (0.72) P2RY12MEN1KMT2ACYP8B1DPP4
SCHEMBL1968277 0.83 P2RY12 (0.61) P2RY12MEN1KMT2ACYP8B1DPP4
SCHEMBL1969151 0.83 P2RY12 (0.61) P2RY12MEN1KMT2ACYP8B1DPP4
SCHEMBL1966723 0.83 P2RY12 (0.61) P2RY12MEN1KMT2ACYP8B1DPP4
SCHEMBL1966977 0.82 P2RY12 (0.73) P2RY12MEN1KMT2ACYP8B1HTR6
SCHEMBL1968670 0.82 P2RY12 (0.73) P2RY12MEN1KMT2ACYP8B1HTR6
SCHEMBL1971308 0.82 P2RY12 (0.73) P2RY12MEN1KMT2ACYP8B1HTR6
SCHEMBL1967653 0.82 P2RY12 (0.59) P2RY12MEN1KMT2AHTR6
SCHEMBL1968668 0.82 P2RY12 (0.73) P2RY12MEN1KMT2ACYP8B1HTR6
SCHEMBL1969306 0.82 P2RY12 (0.59) P2RY12MEN1KMT2AHTR6

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-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

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.