SCHEMBL1128765

SCHEMBL1128765

CC1(C)OB(c2ccc(C(=O)c3ccccc3)nc2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HB P07237 1/20 0.50
LIPG Q9Y5X9 4/20 0.46
LPL P06858 3/20 0.46
DGAT1 O75907 2/20 0.44
KMT2A Q03164 2/20 0.44
PDGFRB P09619 2/20 0.43
KDR P35968 2/20 0.43
USP30 Q70CQ3 1/20 0.42
CNR2 P34972 1/20 0.38
F2 P00734 2/20 0.38
F11 P03951 2/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
LIPE Q05469 1/20 0.38
F10 P00742 1/20 0.37
LTC4S Q16873 1/20 0.37
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL22843330 0.85 DGAT1 (0.44) P4HBLIPGLPLDGAT1KMT2A
SCHEMBL2799277 0.84 DGAT1 (0.49) P4HBLIPGLPLDGAT1KMT2A
SCHEMBL19167147 0.82 P4HB (0.40) P4HBLIPGLPLDGAT1USP30
SCHEMBL2640279 0.81 DGAT1 (0.49) P4HBLIPGLPLDGAT1PDGFRB
SCHEMBL5800648 0.81 P4HB (0.62) P4HBLIPGLPLF2F11
SCHEMBL30015062 0.80 DGAT1 (0.48) P4HBLIPGLPLDGAT1KMT2A
SCHEMBL2068378 0.80 DGAT1 (0.48) P4HBLIPGLPLDGAT1KMT2A
SCHEMBL12314957 0.78 HCAR3 (0.56) P4HBDGAT1KMT2APDGFRBKDR
SCHEMBL16023926 0.78 LIPE (0.47) DGAT1KMT2AF2F11PRSS1
SCHEMBL1083587 0.77 DGAT1 (0.55) P4HBLIPGLPLDGAT1PDGFRB

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-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
EP-2283020-B1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARM INC (US) 2012-10-31 EP disclosed
EP-2283020-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI Pharmaceuticals, Inc. (US) 2011-02-16 EP disclosed
WO-2009143051-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-26 WO disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 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-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES ABL1, TPMT, CYP2C19 P4HB 882/4885LIPG 4744/4885LPL 4530/4885

“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.