SCHEMBL17436760

SCHEMBL17436760

C=C(C)C(=O)Br.C=C(C)C(=O)I

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.40
ALDH1A1 P00352 1/20 0.35
CA1 P00915 2/20 0.33
HSD17B10 Q99714 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
SCHEMBL491133 0.87
SCHEMBL868089 0.87
SCHEMBL28584942 0.78 TDP1 (0.42) TDP1ALDH1A1CA1HSD17B10
Methacrylic Acid SCHEMBL10760313 0.65 TDP1 (0.50) TDP1ALDH1A1CA1HSD17B10
SCHEMBL2423495 0.65
Methacrylic Acid SCHEMBL6914317 0.65
SCHEMBL14647635 0.65
SCHEMBL29036811 0.65 TDP1 (0.42) TDP1ALDH1A1HSD17B10
SCHEMBL8470170 0.63
SCHEMBL8810584 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9782521-B2 Medical device and method for producing medical device TERUMO KABUSHIKI KAISHA (JP) 2017-10-10 US disclosed
US-20160015869-A1 MEDICAL DEVICE AND METHOD FOR PRODUCING MEDICAL DEVICE TERUMO KABUSHIKI KAISHA (JP) 2016-01-21 US disclosed