SCHEMBL8520490

SCHEMBL8520490

C=CCC(=O)OC(=O)CCCCCCCCCCCCCCCCC.[LiH]

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.59
DGKA P23743 1/20 0.48
FAAH O00519 1/20 0.46
LMNA P02545 4/20 0.46
ALDH1A1 P00352 3/20 0.44
PAM P19021 2/20 0.44
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43
CES2 O00748 3/20 0.42
CES1 P23141 3/20 0.42
DNM1 Q05193 1/20 0.41
POLB P06746 1/20 0.41
POLA1 P09884 1/20 0.41

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
SCHEMBL16551768 0.98 TSHR (0.61) TSHRDGKAFAAHLMNAALDH1A1
SCHEMBL27801536 0.98 TSHR (0.61) TSHRDGKAFAAHLMNAALDH1A1
SCHEMBL8518941 0.96 TSHR (0.59) TSHRDGKAFAAHLMNAALDH1A1
SCHEMBL9857527 0.96 TSHR (0.58) TSHRDGKAFAAHLMNAALDH1A1
SCHEMBL9301255 0.87 ALDH1A1 (0.45) TSHRDGKAFAAHLMNAALDH1A1
SCHEMBL6479898 0.84 DGKA (0.64) TSHRDGKALMNAALDH1A1PAM
SCHEMBL8400656 0.84 DGKA (0.64) TSHRDGKALMNAALDH1A1PAM
SCHEMBL28364133 0.84 LMNA (0.65) TSHRDGKAFAAHLMNAALDH1A1
SCHEMBL9120667 0.84 LMNA (0.65) TSHRDGKAFAAHLMNAALDH1A1
SCHEMBL27813635 0.84 LMNA (0.65) TSHRDGKAFAAHLMNAALDH1A1

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-5997621-A Coating composition having anti-reflective and anti-fogging properties MINNESOTA MINING AND MANUFACTURING CO. (US) 1999-12-07 US disclosed
US-5873931-A DISPOSABLE MASKS AND EYE SHIELDS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-02-23 US disclosed