SCHEMBL7471680

SCHEMBL7471680

C#CCC1(C)CCOc2c(CO)cccc21

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 1/20 0.30

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
SCHEMBL6340481 0.72 PTGS1 (0.32)
SCHEMBL6349558 0.67
SCHEMBL27967814 0.63 KDM1A (0.39)
SCHEMBL24258177 0.62 HDAC4 (0.39)
SCHEMBL28207710 0.62 CNR2 (0.33)
SCHEMBL2260257 0.62 MTNR1A (0.57) PDCD1CD274
SCHEMBL24258204 0.61 HDAC3 (0.35)
SCHEMBL1150770 0.60 PARP1 (0.51) PDCD1CD274
SCHEMBL3424828 0.60 ITGB2 (0.39)
SCHEMBL7144622 0.60 ITGB2 (0.39)

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
EP-0977749-B1 BI-AROMATIC COMPOUNDS AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RES & DEV (FR) 2002-03-13 EP disclosed