SCHEMBL8834834

SCHEMBL8834834

CCC=CCCCCC=CCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
CYP19A1 P11511 4/20 0.50
F7 P08709 3/20 0.50
F3 P13726 3/20 0.50
MAPT P10636 3/20 0.50
OXER1 Q8TDS5 3/20 0.50
PPARG P37231 3/20 0.50
PTGS1 P23219 2/20 0.50
KMT2A Q03164 2/20 0.50
PPARD Q03181 2/20 0.50
PPARA Q07869 2/20 0.50
CYP3A4 P08684 2/20 0.50
ALOX15 P16050 2/20 0.50
HSD17B10 Q99714 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
NR1I2 O75469 2/20 0.50
PTGS2 P35354 2/20 0.50
FFAR1 O14842 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50

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
SCHEMBL8834831 1.00 ALDH1A1 (0.50) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL3320012 0.96 ALDH1A1 (0.54) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL5054215 0.96 ALDH1A1 (0.54) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL5054346 0.96 ALDH1A1 (0.54) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL532614 0.92 ALDH1A1 (0.48) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL532615 0.92 ALDH1A1 (0.48) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL960733 0.90 FAAH (0.52) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL54774 0.90
SCHEMBL10021951 0.90
SCHEMBL54775 0.90

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103732678-B Solar cell sealing material, the manufacture method of solar cell sealing material and solar module 三井化学东赛璐株式会社 2018-04-10 CN disclosed
US-5665680-A Method for increasing yield of soybean by inhibition of gibberellin biosynthesis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-09-09 US disclosed
CN-1123083-A Method for increasing yield of soybean SUMITOMO CHEMICAL CO (JP) 1996-05-29 CN disclosed
US-5168059-A Improving viability of plantlets on transfer from in vitro to in vivo conditions by incorporating paclobutrazol in tissue culture medium IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-01 US disclosed
EP-0252617-A2 Micropropagation process IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-01-13 EP disclosed
EP-0212822-A1 A composition containing a plant growth regulator and an alkanol and a method of using the same ICI AMERICAS INC. (US) 1987-03-04 EP disclosed