SCHEMBL28056042

SCHEMBL28056042

CC1(C)C=Cc2ccccc21.[H+]

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
OXTR P30559 1/20 0.34
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
PDK2 Q15119 1/20 0.30
PDK4 Q16654 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
SCHEMBL251287 0.98 KDM4E (0.39) KDM4EPKMOXTRGAAMAPT
SCHEMBL29387054 0.98 KDM4E (0.39) KDM4EPKMOXTRGAAMAPT
SCHEMBL27414073 0.95 KDM4E (0.38) KDM4EPKMOXTRGAAMAPT
Ammonia Solution, Strong SCHEMBL7086115 0.95 KDM4E (0.38) KDM4EPKMOXTRGAAMAPT
Oxalic Acid SCHEMBL27277403 0.84 KDM4E (0.36) KDM4EPKMOXTR
SCHEMBL19933057 0.76 OXTR (0.36) KDM4EPKMOXTR
SCHEMBL8861340 0.74 OXTR (0.33) KDM4EPKMOXTRGAAMAPT
SCHEMBL8737325 0.74 OXTR (0.33) KDM4EPKMOXTRGAAMAPT
SCHEMBL5090884 0.74 OXTR (0.33) KDM4EPKMOXTRGAAMAPT
Hydrochloric Acid SCHEMBL8675870 0.74 OXTR (0.33) KDM4EPKMOXTRGAAMAPT

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-105408399-B Novel polymers and thermosetting compositions containing same 富士胶片电子材料美国有限公司 2019-01-01 CN disclosed
CN-105408399-A Novel polymers and thermosetting compositions containing same FUJIFILM ELECTRONIC MAT USA INC 2016-03-16 CN disclosed