SCHEMBL28367496

SCHEMBL28367496

[CH]=C/C1=C/CCCCCC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.31
HDAC4 P56524 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL6258654 1.00
SCHEMBL3216569 0.97
SCHEMBL3224853 0.90
SCHEMBL2010366 0.79 KDM1A (0.33) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL28419841 0.79 KDM1A (0.33) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL9647725 0.76 KDM1A (0.34) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL7609745 0.76 KDM1A (0.34) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL9647720 0.76 KDM1A (0.34) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL117200 0.75 KDM1A (0.31) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL3206624 0.75 KDM1A (0.31) KDM1AHDAC4HDAC2HDAC8HDAC6

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
CN-110713601-B Quick-curing hydrogel based on bioorthogonal reaction, preparation method and application thereof 中国科学院苏州纳米技术与纳米仿生研究所 2021-04-30 CN disclosed
CN-110713601-A Quick-curing hydrogel based on bioorthogonal reaction, preparation method and application thereof 中国科学院苏州纳米技术与纳米仿生研究所 2020-01-21 CN disclosed