SCHEMBL844657

SCHEMBL844657

COc1ccc(C2(c3nnc4ncc(-c5cccc(-c6ccc(C)cc6)c5)nn34)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.41
FLT3 P36888 1/20 0.39
HSD11B1 P28845 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA1 P30542 1/20 0.37
NR1I2 O75469 1/20 0.36
ABL1 P00519 1/20 0.35
ABCB1 P08183 1/20 0.35
BCR P11274 1/20 0.35
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 1/20 0.35
STAT1 P42224 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
FYN P06241 2/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 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
SCHEMBL837046 0.89 MET (0.48) METALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL836938 0.88 PSEN1 (0.38) METNPC1RAB9ASMN1; SMN2FYN
SCHEMBL837667 0.88 PIK3CD (0.40) METHSD11B1
SCHEMBL836950 0.87 MET (0.39) METHSD11B1FYN
SCHEMBL835601 0.87 MET (0.51) METHSD11B1ALDH1A1NPC1STAT1
SCHEMBL835960 0.87 MET (0.40) METADORA1ALDH1A1NPC1STAT1
SCHEMBL837238 0.86 MET (0.46) METALDH1A1NPC1STAT1RAB9A
SCHEMBL844278 0.85 HSD11B1 (0.37) FLT3HSD11B1ADORA3ADORA1NR1I2
SCHEMBL836458 0.83 MET (0.47) METHSD11B1NR1I2L3MBTL1MEN1
SCHEMBL837350 0.83 MET (0.42) METHSD11B1NR1I2ALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143251-B2 Triazolotriazines as kinase inhibitors INCYTE CORPORATION (US) 2012-03-27 US disclosed
US-20110144113-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION 2011-06-16 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-20110144113-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS MET, ERBB2, RET MET 1/4885FLT3 18/4885HSD11B1 3686/4885

“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.