SCHEMBL967759

SCHEMBL967759

[C]#CCCC(=O)N1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.56
ALDH1A1 P00352 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MEN1 O00255 2/20 0.50
GAA P10253 2/20 0.42
NPC1 O15118 3/20 0.42
HPGD P15428 5/20 0.40
HSD17B10 Q99714 2/20 0.40
RAB9A P51151 2/20 0.40
CYP3A4 P08684 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 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
SCHEMBL966592 0.98 ATM (0.58) ATMALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL965819 0.88 ATM (0.63) ATMALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL969348 0.86 ATM (0.65) ATMALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL3498066 0.81 ATM (0.58) ATMALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL2576210 0.80 L3MBTL1 (0.50) ALDH1A1SMN1; SMN2L3MBTL1GAANPC1
SCHEMBL15680569 0.79 ATM (0.56) ATMALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL5256967 0.79 ATM (0.56) ATMALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL970310 0.78 ATM (0.48) ATMALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL5530064 0.78 ATM (0.60) ATMALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL25433244 0.77 ATM (0.58) ATMALDH1A1TDP1KMT2ASMN1; 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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102333760-B Halogen-containing organosulfur compounds and use thereof for controlling arthropod pest SUMITOMO CHEMICAL CO 2014-04-09 CN disclosed
CN-102036951-B Nitrile compound and its use for control of arthropod pest SUMITOMO CHEMICAL CO 2014-02-19 CN disclosed
CN-101790511-B Halogen-containing organosulfur compounds and uses thereof SUMITOMO CHEMICAL CO 2013-12-11 CN disclosed
US-8513162-B2 Halogen-containing organosulfur compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-08-20 US disclosed
US-8344163-B2 Nitrile compound and its use for control of arthropod pest SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-01-01 US disclosed
US-8247596-B2 Halogen-containing organosulfur compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-21 US disclosed
CN-102333760-A Halogen-containing organosulfur compounds and use thereof for controlling arthropod pest SUMITOMO CHEMICAL CO 2012-01-25 CN disclosed
US-20110257226-A1 HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-20 US disclosed
EP-2347653-A2 Animal ectoparasite control composition Sumitomo Chemical Company, Limited (JP) 2011-07-27 EP disclosed
US-20110160251-A1 ANIMAL ECTOPARASITE CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-30 US disclosed
CN-102036951-A Nitrile compound and its use for control of arthropod pest SUMITOMO CHEMICAL CO 2011-04-27 CN disclosed
US-20110021627-A1 NITRILE COMPOUND AND ITS USE FOR CONTROL OF ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-27 US disclosed
CN-101790511-A Halogen-containing organosulfur compounds and uses thereof SUMITOMO CHEMICAL CO 2010-07-28 CN disclosed
US-20100160422-A1 HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 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 (4 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-20110021627-A1 NITRILE COMPOUND AND ITS USE FOR CONTROL OF ARTHROPOD PEST C5, OR10J3, NOX3 ATM 4091/4885ALDH1A1 2305/4885TDP1 4624/4885
US-20110160251-A1 ANIMAL ECTOPARASITE CONTROL COMPOSITION ADIPOR1, ADIPOR2, PLIN3 ATM 4330/4885ALDH1A1 2168/4885TDP1 4014/4885
US-20100160422-A1 HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF C5, C1S, C9 ATM 3068/4885ALDH1A1 1797/4885TDP1 4114/4885
US-20110257226-A1 HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF C1S, C5, L3MBTL3 ATM 3906/4885ALDH1A1 1174/4885TDP1 3937/4885

“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.