SCHEMBL21553357

SCHEMBL21553357

CCCCNCC(C)(CC)CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ADH1B P00325 2/20 0.37
ADH1C P00326 2/20 0.37
ADH1A P07327 2/20 0.37
ADH7 P40394 2/20 0.37
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA12 O43570 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CYP2C19 P33261 2/20 0.32
MEN1 O00255 1/20 0.32
GLA P06280 1/20 0.32
KMT2A Q03164 1/20 0.32
EPHX1 P07099 2/20 0.31
ADH4 P08319 1/20 0.31

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
SCHEMBL24922872 0.84 TSHR (0.33) TSHR
SCHEMBL22281125 0.80 CA12 (0.43) TSHRALDH1A1CA1CA2CA12
SCHEMBL26503985 0.80 TSHR (0.48) TSHRALDH1A1POLBSMN1; SMN2L3MBTL1
SCHEMBL25983620 0.79 TSHR (0.42) TSHRALDH1A1POLBSMN1; SMN2L3MBTL1
SCHEMBL10198685 0.79 TSHR (0.52) TSHRALDH1A1POLBSMN1; SMN2L3MBTL1
SCHEMBL8403513 0.75 TSHR (0.48) TSHRALDH1A1POLBSMN1; SMN2L3MBTL1
SCHEMBL13937213 0.75 TSHR (0.48) TSHRALDH1A1POLBSMN1; SMN2L3MBTL1
SCHEMBL15114076 0.75 TSHR (0.48) TSHRALDH1A1POLBSMN1; SMN2L3MBTL1
SCHEMBL15114038 0.73 TSHR (0.46) TSHRALDH1A1POLBSMN1; SMN2L3MBTL1
SCHEMBL5697229 0.73 TSHR (0.46) TSHRALDH1A1POLBSMN1; SMN2L3MBTL1

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
EP-3564318-A1 AQUEOUS DISPERSION, METHOD FOR PRODUCING SAME AND IMAGE FORMATION METHOD FUJIFILM Corporation (JP) 2019-11-06 EP disclosed