SCHEMBL4869212

SCHEMBL4869212

CCCCC(C#N)(C#N)CC(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 4/20 0.34
CA12 O43570 2/20 0.34
CA14 Q9ULX7 2/20 0.34
POLB P06746 1/20 0.34
POLA1 P09884 1/20 0.34
CA2 P00918 2/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
EPHX1 P07099 1/20 0.32
BIRC2 Q13490 1/20 0.31
CA1 P00915 1/20 0.31
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL4868566 0.84 MEN1 (0.39) MEN1HPGDKMT2ATSHRMGAM
SCHEMBL4865786 0.83 NAAA (0.42) MEN1HPGDKMT2ALMNATSHR
SCHEMBL4869137 0.83 CTSK (0.37)
SCHEMBL4867861 0.79 TSHR (0.32) HSD17B10HPGDTSHRMGAMGAA
SCHEMBL4861183 0.78 CTSK (0.36)
SCHEMBL4870531 0.77 CTSS (0.35) MEN1KMT2ATSHR
SCHEMBL11857578 0.73 TSHR (0.41) LMNATSHRALDH1A1
SCHEMBL27403262 0.73 FFAR1 (0.43) RECQLHSD17B10MEN1HPGDKMT2A
SCHEMBL4870067 0.73 CTSK (0.35) HSD17B10MEN1KMT2ALMNACA12
SCHEMBL6818847 0.72 CYP1A2 (0.42) HSD17B10MEN1KMT2ATSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7439266-B2 Malononitrile compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-21 US disclosed
US-7439266-B2 Malononitrile compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-21 US disclosed
US-20060004092-A1 Malononitrile compound and use thereof pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-01-05 US disclosed
WO-2004020399-A1 MALONONITRILE COMPOUND AND USE THEREOF AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-03-11 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-20060004092-A1 Malononitrile compound and use thereof pesticides ME1, MAL2, ME3 RECQL 4276/4885HSD17B10 1168/4885MEN1 215/4885

“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.