SCHEMBL4248962

SCHEMBL4248962

C#CCOc1c(F)cc(C(=O)NCC2CCCC2)cc1OC

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.65
ABCG2 Q9UNQ0 1/20 0.44
KMT2A Q03164 2/20 0.43
KCNH2 Q12809 1/20 0.43
HPGD P15428 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
ALDH1A1 P00352 2/20 0.40
POLB P06746 2/20 0.40
TP53 P04637 1/20 0.40
GAA P10253 1/20 0.40
MCHR1 Q99705 1/20 0.40
PDE10A Q9Y233 1/20 0.40
ATM Q13315 1/20 0.40
MMP13 P45452 1/20 0.39

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
SCHEMBL4242119 0.99 TDP1 (0.67) TDP1ABCG2KMT2AKCNH2HPGD
SCHEMBL4240864 0.98 TDP1 (0.61) TDP1ABCG2KMT2AKCNH2HPGD
SCHEMBL12799554 0.92 TDP1 (0.72) TDP1ABCG2KMT2AHPGDSIRT5
SCHEMBL4248420 0.91 TDP1 (0.74) TDP1ABCG2KMT2AHPGDSIRT5
SCHEMBL4251856 0.90 TDP1 (0.68) TDP1ABCG2KMT2AHPGDSIRT5
SCHEMBL4252787 0.90 TDP1 (0.51) TDP1KMT2APOLBMMP13
SCHEMBL4245881 0.90 TDP1 (0.51) TDP1KMT2ASIRT5ALDH1A1POLB
SCHEMBL4240818 0.89 TDP1 (0.53) TDP1KMT2APOLBMMP13
SCHEMBL4244301 0.89 TDP1 (0.53) TDP1KMT2AALDH1A1POLBTP53
SCHEMBL4245813 0.88 TDP1 (0.64) TDP1ABCG2KMT2ASIRT5TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902400-B2 N-(1,1-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; N-(2,2-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-08 US disclosed
US-7902400-B2 N-(1,1-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; N-(2,2-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-08 US disclosed
US-7902400-B2 N-(1,1-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; N-(2,2-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-08 US disclosed
US-20090131531-A1 Amide Compounds and their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-21 US disclosed
US-20090131531-A1 Amide Compounds and their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-21 US disclosed
US-20090131531-A1 Amide Compounds and their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-21 US disclosed
EP-1940780-A1 AMIDE COMPOUNDS AND THEIR USE SUMITOMO CHEMICAL CO., LTD. (JP) 2008-07-09 EP disclosed
WO-2007049728-A1 AMIDE COMPOUNDS AND THEIR USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-03 WO disclosed
WO-2007049728-A1 AMIDE COMPOUNDS AND THEIR USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-03 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-20090131531-A1 Amide Compounds and their Use NAT1, ACAT2, NAAA TDP1 3052/4885ABCG2 2504/4885KMT2A 909/4885

“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.