SCHEMBL11399196

SCHEMBL11399196

CCCCCCCCCOP(Oc1ccc(C(C)(C)CC(C)(C)C)cc1)Oc1ccc(C(C)(C)CC(C)(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
SHBG P04278 1/20 0.39
S1PR1 P21453 1/20 0.37
CNR2 P34972 1/20 0.37
NR5A1 Q13285 1/20 0.36
HRH3 Q9Y5N1 11/20 0.35
MAOB P27338 4/20 0.35
MEN1 O00255 2/20 0.34
APAF1 O14727 2/20 0.34
USP2 O75604 2/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
ERBB2 P04626 2/20 0.34
TP53 P04637 2/20 0.34
FYN P06241 2/20 0.34
CHRM2 P08172 2/20 0.34
CHRM4 P08173 2/20 0.34
CHRM5 P08912 2/20 0.34
ADRA2A P08913 2/20 0.34

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
SCHEMBL11386541 1.00 CYP3A4 (0.46) CYP3A4SMN1; SMN2SHBGS1PR1CNR2
SCHEMBL7641671 0.85 HRH3 (0.40) SMN1; SMN2S1PR1NR5A1HRH3MEN1
SCHEMBL11158970 0.85 HRH3 (0.40) SMN1; SMN2S1PR1NR5A1HRH3MEN1
SCHEMBL1159982 0.82 NR5A1 (0.40) SMN1; SMN2S1PR1CNR2NR5A1LMNA
SCHEMBL6742945 0.82 NR5A1 (0.40) SMN1; SMN2S1PR1CNR2NR5A1LMNA
SCHEMBL12997310 0.82 HRH3 (0.40) SMN1; SMN2S1PR1NR5A1HRH3MEN1
SCHEMBL11638026 0.82 HRH3 (0.40) SMN1; SMN2S1PR1NR5A1HRH3MEN1
SCHEMBL10513790 0.82 CYP3A4 (0.66) CYP3A4SMN1; SMN2S1PR1NR5A1HRH3
SCHEMBL18496995 0.81 SMN1; SMN2 (0.44) SMN1; SMN2MEN1ALDH1A1LMNAHTT
SCHEMBL5085660 0.81 LTA4H (0.45) CYP3A4SMN1; SMN2NR5A1HRH3ALDH1A1

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
US-4255321-A BLENDS WITH HIGH IMPACT-STRENGTH BUTADIENE-STYRENE COPOLYMER INCLUDE A SYNERGISTIC MIXTURE OF A METAL SULFIDE AND ZINC OXIDE; ENGINEERING THERMOPLASTICS GENERAL ELECTRIC COMPANY (US) 1981-03-10 US disclosed
US-4123474-A STABILIZED THERMOPLASTIC MOLDING MATERIAL GENERAL ELECTRIC COMPANY (US) 1978-10-31 US disclosed