SCHEMBL3572014

SCHEMBL3572014

O=C1Nc2ccccc2/C1=C\c1cccc(F)c1F

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.81
PLK4 O00444 2/20 0.62
PLK1 P53350 2/20 0.62
KDR P35968 5/20 0.58
FLT3 P36888 7/20 0.57
MAP3K7 O43318 1/20 0.55
TAB1 Q15750 1/20 0.55
RET P07949 4/20 0.53
PDGFRB P09619 4/20 0.53
NTRK1 P04629 3/20 0.53
DAPK3 O43293 2/20 0.53
PRKD3 O94806 2/20 0.53
MAP4K4 O95819 2/20 0.53
LCK P06239 2/20 0.53
FYN P06241 2/20 0.53
CSF1R P07333 2/20 0.53
LTK P29376 2/20 0.53
MAPK8 P45983 2/20 0.53
CSNK1A1 P48729 2/20 0.53
CDK7 P50613 2/20 0.53

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
SCHEMBL5465411 0.89 NPC1 (1.00) NPC1PLK4PLK1KDRFLT3
SCHEMBL3567966 0.89 NPC1 (1.00) NPC1PLK4PLK1KDRFLT3
SCHEMBL5465409 0.89 NPC1 (1.00) NPC1PLK4PLK1KDRFLT3
SCHEMBL14659628 0.82 NPC1 (0.56) NPC1PDGFRBLRRK2
SCHEMBL14659629 0.82 NPC1 (0.56) NPC1PDGFRBLRRK2
SCHEMBL7138923 0.82 NPC1 (0.56) NPC1PLK4PLK1KDRFLT3
SCHEMBL5468579 0.78 NPC1 (0.74) NPC1PLK4PLK1KDRFLT3
SCHEMBL5468577 0.78 NPC1 (0.74) NPC1PLK4PLK1KDRFLT3
SCHEMBL5469699 0.78 NPC1 (0.64) NPC1PLK4PLK1KDRFLT3
SCHEMBL5469703 0.78 NPC1 (0.64) NPC1PLK4PLK1KDRFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842705-B2 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY (US) 2010-11-30 US disclosed
US-7842705-B2 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY (US) 2010-11-30 US disclosed
US-7842705-B2 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY (US) 2010-11-30 US disclosed
US-20080234320-A1 CURCUMIN ANALOGS WITH ANTI-TUMOR AND ANTI-ANGIOGENIC PROPERTIES EMORY UNIVERSITY 2008-09-25 US disclosed
US-20080234320-A1 CURCUMIN ANALOGS WITH ANTI-TUMOR AND ANTI-ANGIOGENIC PROPERTIES EMORY UNIVERSITY 2008-09-25 US disclosed
US-20080234320-A1 CURCUMIN ANALOGS WITH ANTI-TUMOR AND ANTI-ANGIOGENIC PROPERTIES EMORY UNIVERSITY 2008-09-25 US disclosed
US-7371766-B2 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY (US) 2008-05-13 US disclosed
US-7371766-B2 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY (US) 2008-05-13 US disclosed
US-7371766-B2 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY (US) 2008-05-13 US disclosed
US-20040176384-A1 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY 2004-09-09 US disclosed
US-6664272-B2 Such as 1,5-Bis-(2, 4-difluorophenyl)penta-1,4-diene-3 -one; administering to inhibit tissue factor and vascular endothelial growth factor (VEGF) production in cancerous tissue EMORY UNIVERSITY 2003-12-16 US disclosed
EP-1242379-A1 CURCUMIN ANALOGUES FOR TREATING CANCER Emory University (US) 2002-09-25 EP disclosed
WO-2001040188-A9 CURCUMIN ANALOGUES FOR TREATING CANCER UNIV EMORY (US) 2002-07-25 WO disclosed
US-20020019382-A1 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY 2002-02-14 US disclosed
WO-2001040188-A1 CURCUMIN ANALOGUES FOR TREATING CANCER EMORY UNIVERSITY (US) 2001-06-07 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 (3 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-20040176384-A1 Curcumin analogs with anti-tumor and anti-angiogenic properties PGF, VEGFA, VHL NPC1 3599/4885PLK4 3035/4885PLK1 1734/4885
US-20080234320-A1 CURCUMIN ANALOGS WITH ANTI-TUMOR AND ANTI-ANGIOGENIC PROPERTIES PGF, VEGFA, VHL NPC1 3599/4885PLK4 3035/4885PLK1 1734/4885
US-20020019382-A1 Curcumin analogs with anti-tumor and anti-angiogenic properties PGF, VEGFA, VHL NPC1 3599/4885PLK4 3035/4885PLK1 1734/4885

“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.