SCHEMBL9150682

SCHEMBL9150682

CCCCCCCCCCCCCCCCC(CC)C(=O)N(CC(O)CO)CC(CCCC)CCCCCC

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
CA2 P00918 7/20 0.40
MAPK1 P28482 1/20 0.39
CA1 P00915 4/20 0.38
ALDH1A1 P00352 1/20 0.38
GPR84 Q9NQS5 4/20 0.36
FFAR4 Q5NUL3 1/20 0.36
FFAR1 O14842 1/20 0.36
KDM4E B2RXH2 1/20 0.35
DUSP3 P51452 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL9147303 0.93 LMNA (0.44) LMNACA2GPR84FFAR4FFAR1
SCHEMBL9114413 0.90 LMNA (0.39) LMNACA2ALDH1A1GPR84FFAR4
SCHEMBL9115567 0.88 LMNA (0.40) LMNACA2MAPK1CA1GPR84
SCHEMBL9150762 0.88 LMNA (0.40) LMNACA2ALDH1A1GPR84FFAR4
SCHEMBL9240241 0.82 CA2 (0.41) LMNACA2GPR84FFAR4FFAR1
SCHEMBL3965945 0.81 CA2 (0.50) CA2MAPK1CA1ALDH1A1
SCHEMBL9116088 0.81 LMNA (0.38) LMNACA2ALDH1A1GPR84FFAR4
SCHEMBL2492995 0.77 FFAR4 (0.46) LMNAALDH1A1GPR84FFAR4FFAR1
SCHEMBL29144960 0.74 CA2 (0.48) CA2MAPK1CA1GPR84FFAR1
SCHEMBL2502353 0.73 GPR84 (0.45) LMNAGPR84FFAR4FFAR1KDM4E

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-5476671-A Skin disorders CHESEBROUGH-POND'S USA CO., DIVISION OF CONOPCO, INC. (US) 1995-12-19 US disclosed