SCHEMBL8108916

SCHEMBL8108916

CCC(Cl)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.48
ALDH1A1 P00352 4/20 0.48
TP53 P04637 1/20 0.48
LMNA P02545 2/20 0.46
AOC3 Q16853 1/20 0.45
SIGMAR1 Q99720 1/20 0.43
ADRA2B P18089 2/20 0.42
ADRA2C P18825 2/20 0.42
SLC6A2 P23975 2/20 0.42
HTR2A P28223 2/20 0.42
ADRA1A P35348 2/20 0.42
SLC6A3 Q01959 2/20 0.42
KCNH2 Q12809 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CYP2C19 P33261 2/20 0.42
SLC22A2 O15244 1/20 0.42
SLC22A1 O15245 1/20 0.42
SLC22A3 O75751 1/20 0.42
ESR1 P03372 1/20 0.42
CHRM2 P08172 1/20 0.42

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
SCHEMBL8108561 0.86 TSHR (0.43) TSHRALDH1A1TP53LMNAAOC3
SCHEMBL8099825 0.83 SIGMAR1 (0.41) TSHRALDH1A1TP53LMNAAOC3
SCHEMBL8114380 0.80 TSHR (0.50) TSHRALDH1A1TP53LMNAAOC3
SCHEMBL19244148 0.80 TSHR (0.50) TSHRALDH1A1TP53LMNAAOC3
Hydrochloric Acid SCHEMBL3372152 0.79 TSHR (0.50) TSHRALDH1A1LMNAAOC3SIGMAR1
SCHEMBL18379386 0.78 ADRA2B (0.52) TSHRALDH1A1TP53LMNAAOC3
SCHEMBL14500990 0.78 ADRA2B (0.52) TSHRALDH1A1TP53LMNAAOC3
Hydrochloric Acid SCHEMBL7229811 0.78 TSHR (0.49) TSHRALDH1A1TP53LMNAAOC3
SCHEMBL4432874 0.77 TSHR (0.46) TSHRALDH1A1TP53LMNAAOC3
SCHEMBL3203375 0.77 AOC3 (0.48) TSHRALDH1A1TP53LMNAAOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9463262-B2 Cell adhesive material for biological tissue SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2016-10-11 US disclosed
US-20130289254-A1 CELL ADHESIVE MATERIAL FOR BIOLOGICAL TISSUE SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2013-10-31 US disclosed
EP-2636415-A1 CELL ADHESIVE MATERIAL FOR BIOLOGICAL TISSUE Sanyo Chemical Industries, Ltd. (JP) 2013-09-11 EP disclosed
EP-1056744-A1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES Aventis Pharmaceuticals Inc. (US) 2000-12-06 EP disclosed
WO-1999043675-A1 6,9-DISUBSTITUTED 2-[TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMACEUTICALS INC. (US) 1999-09-02 WO disclosed