SCHEMBL28295709

SCHEMBL28295709

CCCCN(NC(N)=S)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.35
CA12 O43570 4/20 0.35
CA9 Q16790 4/20 0.35
ALDH1A1 P00352 2/20 0.35
ALDH2 P05091 1/20 0.35
CA2 P00918 3/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP8 P22894 1/20 0.33
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.31
TAS2R38 P59533 1/20 0.31
KDM5A P29375 3/20 0.31
KDM4C Q9H3R0 2/20 0.31
MAPT P10636 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL1838870 0.78 KDM5A (0.34) CA1CA12CA9ALOX15KDM5A
SCHEMBL27464906 0.73 CA1 (0.35) CA1CA12CA9CA2MMP1
SCHEMBL9561921 0.73 HSP90AA1 (0.48) MEN1KMT2A
SCHEMBL11837227 0.72 ALOX15 (0.36) ALOX15KDM5AKDM4CMAPTMEN1
SCHEMBL6427083 0.71 CA12 (0.36) CA1CA12CA9CA2
SCHEMBL17164846 0.71 CA12 (0.48) CA1CA12CA9ALDH1A1ALDH2
Thiourea SCHEMBL17164885 0.69 CA12 (0.47) CA1CA12CA9ALDH1A1ALDH2
SCHEMBL28834261 0.69 EPHX1 (0.48) MMP1MMP2
SCHEMBL9456807 0.69 CA1 (0.46) CA1CA12CA9ALDH1A1CA2
SCHEMBL10770104 0.68 CA12 (0.41) CA1CA12CA9ALDH1A1ALDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109715695-A Resin composition, adhesive, sealing material, dam agent, semiconductor device, and image sensor module 纳美仕有限公司 2019-05-03 CN disclosed