SCHEMBL7712115

SCHEMBL7712115

NCCNCCCCCCCCCCNCCN

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.79
CA6 P23280 5/20 0.79
CA7 P43166 5/20 0.79
CA9 Q16790 5/20 0.79
CA14 Q9ULX7 5/20 0.79
CA5B Q9Y2D0 5/20 0.79
CA2 P00918 4/20 0.79
CA4 P22748 4/20 0.79
CA5A P35218 4/20 0.79
CA3 P07451 3/20 0.79
MEN1 O00255 2/20 0.77
RECQL P46063 2/20 0.77
KMT2A Q03164 2/20 0.77
ALOX15 P16050 3/20 0.73
F13A1 P00488 2/20 0.73
CYP1A2 P05177 2/20 0.73
THPO P40225 2/20 0.73
CASP2 P42575 2/20 0.73
CYP2C19 P33261 1/20 0.73
HSD17B10 Q99714 1/20 0.73

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
SCHEMBL6658738 1.00 CA12 (0.79) CA12CA6CA7CA9CA14
SCHEMBL6251707 1.00 CA12 (0.79) CA12CA6CA7CA9CA14
SCHEMBL11808474 0.96 CA12 (0.79) CA12CA6CA7CA9CA14
Hydrochloric Acid SCHEMBL6250226 0.96 UBE2N (0.75) CA12CA6CA7CA9CA14
SCHEMBL9720429 0.96 CA12 (0.79) CA12CA6CA7CA9CA14
SCHEMBL26667 0.96 CA12 (0.85) CA12CA6CA7CA9CA14
SCHEMBL18784646 0.93 CA12 (0.81) CA12CA6CA7CA9CA14
SCHEMBL18700922 0.93 CA12 (0.81) CA12CA6CA7CA9CA14
SCHEMBL817205 0.93 CA12 (0.81) CA12CA6CA7CA9CA14
SCHEMBL7206015 0.93 CA12 (0.81) CA12CA6CA7CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6372871-B1 CURABLE LIQUID MIXTURE OF A POLYMER, PREFERABLY ACRYLIC, HAVING A 1,3-OXATHIOLANE-2-THIOL AND A KETIMINE, ENAMINE OR AN ALDIMINE; COATINGS; ADHESIVES; INKS; SEALS; STORAGE STABILITY KYOWA YUKA CO., LTD. (JP) 2002-04-16 US claimed
EP-0943660-A1 DITHIOCARBONATE COMPOSITION Kyowa Yuka Co., Ltd. (JP) 1999-09-22 EP claimed
US-6372871-B1 CURABLE LIQUID MIXTURE OF A POLYMER, PREFERABLY ACRYLIC, HAVING A 1,3-OXATHIOLANE-2-THIOL AND A KETIMINE, ENAMINE OR AN ALDIMINE; COATINGS; ADHESIVES; INKS; SEALS; STORAGE STABILITY KYOWA YUKA CO., LTD. (JP) 2002-04-16 US disclosed
US-6160044-A Compositions containing dithiocarbonate compound KYOWA YUKA CO., LTD. (JP) 2000-12-12 US disclosed
EP-0972808-A1 COMPOSITION CONTAINING DITHIOCARBONATE COMPOUND Kyowa Yuka Co., Ltd. (JP) 2000-01-19 EP disclosed
EP-0945492-A1 AQUEOUS DISPERSION COMPOSITION Kyowa Yuka Co., Ltd. (JP) 1999-09-29 EP disclosed
EP-0943660-A1 DITHIOCARBONATE COMPOSITION Kyowa Yuka Co., Ltd. (JP) 1999-09-22 EP disclosed
US-5115006-A Modified conjugated diene rubber with alkali or alkaline earth metals, and amine NIPPON ZEON CO., LTD. (JP) 1992-05-19 US disclosed