SCHEMBL5598768

SCHEMBL5598768

CC(=O)Oc1ccc(/C=C/C(=O)/C=C/c2ccc(OC(C)=O)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F3 P13726 3/20 0.67
LMNA P02545 3/20 0.66
MAPT P10636 2/20 0.66
KMT2A Q03164 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
KDM4E B2RXH2 1/20 0.66
MEN1 O00255 1/20 0.66
TTR P02766 1/20 0.66
TP53 P04637 1/20 0.66
CYP3A4 P08684 1/20 0.66
JUN P05412 1/20 0.57
NFKB1 P19838 1/20 0.57
TUBB4A P04350 1/20 0.55
TUBB P07437 1/20 0.55
TUBA3C P0DPH7 1/20 0.55
TUBA1B P68363 1/20 0.55
TUBA4A P68366 1/20 0.55
TUBB4B P68371 1/20 0.55
TUBB3 Q13509 1/20 0.55
TUBB2A Q13885 1/20 0.55

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
SCHEMBL4369837 1.00 F3 (0.67) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL4374186 0.98 F3 (0.65) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL4370893 0.98 F3 (0.65) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL4368151 0.98 F3 (0.65) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL4373949 0.98 F3 (0.65) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL609973 0.88 GSK3B (0.71) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL609972 0.88 GSK3B (0.71) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL2451780 0.88 MAPT (0.81) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL10941162 0.88 MAPT (0.81) F3LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL11354408 0.88 MAPT (0.81) F3LMNAMAPTKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160039734-A1 THERAPEUTIC CURCUMIN DERIVATIVES STC UNM (US) 2016-02-11 US disclosed
US-9187397-B2 Therapeutic curcumin derivatives STC.UNM (US) 2015-11-17 US disclosed
US-20150011494-A1 THERAPEUTIC CURCUMIN DERIVATIVES STC.UNM 2015-01-08 US disclosed
US-8841326-B2 Therapeutic curcumin derivatives STC.UNM (US) 2014-09-23 US disclosed
US-8436197-B2 Palladium complexes and polymerization and coupling processes thereof WEST CHESTER UNIVERSITY OF PENNSYLVANIA OF THE STATE SYSTEM OF HIGHER EDUCATION (US) 2013-05-07 US disclosed
US-8436197-B2 Palladium complexes and polymerization and coupling processes thereof WEST CHESTER UNIVERSITY OF PENNSYLVANIA OF THE STATE SYSTEM OF HIGHER EDUCATION (US) 2013-05-07 US disclosed
US-20090111962-A1 Palladium Complexes and Polymerization and Coupling Processes Thereof WEST CHESTER UNIVERSITY OF PENNSYLVANIA OF THE STATE SYSTEM OF HIGHER EDUCATION 2009-04-30 US disclosed
US-20090111962-A1 Palladium Complexes and Polymerization and Coupling Processes Thereof WEST CHESTER UNIVERSITY OF PENNSYLVANIA OF THE STATE SYSTEM OF HIGHER EDUCATION 2009-04-30 US disclosed
US-20070060644-A1 Therapeutic curcumin derivatives STC.UNM 2007-03-15 US disclosed
US-20060276536-A1 Cancer treatment using curcumin derivatives STC.UNM 2006-12-07 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 (5 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-20160039734-A1 THERAPEUTIC CURCUMIN DERIVATIVES FABP2, GLS2, FABP1 F3 4781/4885LMNA 1060/4885MAPT 448/4885
US-20070060644-A1 Therapeutic curcumin derivatives FABP2, GLS2, FABP1 F3 4781/4885LMNA 1060/4885MAPT 448/4885
US-20090111962-A1 Palladium Complexes and Polymerization and Coupling Processes Thereof DDT, PDCD2L, PDCD1LG2 F3 1590/4885LMNA 4360/4885MAPT 3254/4885
US-20150011494-A1 THERAPEUTIC CURCUMIN DERIVATIVES FABP2, GLS2, FABP1 F3 4781/4885LMNA 1060/4885MAPT 448/4885
US-20060276536-A1 Cancer treatment using curcumin derivatives BRCA1, VHL, TP53 F3 3835/4885LMNA 371/4885MAPT 2066/4885

“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.