SCHEMBL214367

SCHEMBL214367

Cc1cc(N2CCOCC2)ccc1N(C(=O)c1nc[nH]c1C(N)=O)c1nc2ccccc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.40
HTR2B P41595 1/20 0.38
FGFR1 P11362 2/20 0.38
FLT1 P17948 2/20 0.38
PDGFRB P09619 1/20 0.38
KDR P35968 1/20 0.38
NPC1 O15118 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
BRD4 O60885 2/20 0.37
JAK2 O60674 4/20 0.37
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
CBFB Q13951 1/20 0.36
TP53 P04637 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
SCHEMBL214964 0.92 DRD4 (0.39) FGFR1PDGFRBKDRMAPTMAPK1
SCHEMBL214453 0.91 ALDH1A1 (0.37) FGFR1PDGFRBKDRMAPTTDP1
Hydrochloric Acid SCHEMBL214494 0.91 ALDH1A1 (0.36) FGFR1PDGFRBKDRMAPTTDP1
SCHEMBL216124 0.87 PTGDR (0.40) GAAMAPTMAPK1SMN1; SMN2TDP1
SCHEMBL214206 0.87 HTR1A (0.37) MAPTMAPK1SMN1; SMN2TDP1HTR1A
SCHEMBL215214 0.87 KDM4E (0.41) FAAHGAAMAPTMAPK1SMN1; SMN2
SCHEMBL215286 0.85 LTA4H (0.46) FGFR1PDGFRBKDRNPC1RAB9A
SCHEMBL217227 0.84 POLB (0.37) NPC1MAPTRAB9ASMN1; SMN2TDP1
SCHEMBL214317 0.84 LTA4H (0.41) FGFR1PDGFRBKDR
SCHEMBL214715 0.82 POLB (0.40) FGFR1FLT1NPC1GAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US claimed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US claimed
EP-2061768-A2 IMIDAZOLE-4,5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS Exelixis, Inc. (US) 2009-05-27 EP claimed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 WO claimed
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US disclosed
EP-2061768-A2 IMIDAZOLE-4,5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS Exelixis, Inc. (US) 2009-05-27 EP disclosed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 FAAH 4026/4885HTR2B 1533/4885FGFR1 708/4885

“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.