SCHEMBL9777378

SCHEMBL9777378

CC(C)(C)CC(C)(C)c1cccc2c1nnn2-c1ccccc1O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 1/20 0.49
▸ ATM Q13315 1/20 0.34
▸ GRM2 Q14416 1/20 0.34
▸ NR3C1 P04150 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ NR3C2 P08235 1/20 0.33
▸ KCNN4 O15554 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL28820997 0.77 GRM2 (0.39) ATMGRM2ALDH1A1
SCHEMBL7099276 0.75 CYP3A4 (0.41) KCNMA1PGRALDH1A1
SCHEMBL1628796 0.74 KCNMA1 (0.58) KCNMA1ATMGRM2KCNN4ALDH1A1
SCHEMBL7141288 0.73 POLB (0.47) KCNMA1ATMALDH1A1TSHRTDP1
SCHEMBL5183293 0.73 KCNMA1 (0.59) KCNMA1GRM2KCNN4ALDH1A1TSHR
SCHEMBL29576845 0.72 KCNMA1 (0.55) KCNMA1ATMPGRTSHR
SCHEMBL2595377 0.72 KCNMA1 (0.55) KCNMA1ATMPGRTSHR
SCHEMBL8938828 0.71 KCNMA1 (0.47) KCNMA1KCNN4
SCHEMBL324566 0.69 ALDH1A1 (0.58) ATMNR3C1PGRNR3C2ALDH1A1
SCHEMBL29363360 0.69 ALDH1A1 (0.58) ATMNR3C1PGRNR3C2ALDH1A1

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
US-4999393-A Light and heat resistance; stabilizers with antioxidants ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1991-03-12 — — US disclosed
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