SCHEMBL10568561

SCHEMBL10568561

COc1ccc(C2(C)CCc3cc(OC)ccc3C2CCCCC(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RORC P51449 4/20 0.44
PPARD Q03181 2/20 0.43
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HSD17B1 P14061 1/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDE4B Q07343 1/20 0.39

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
SCHEMBL9862607 0.90 FFAR1 (0.42) RORCPPARD
SCHEMBL10449740 0.86 SIGMAR1 (0.41) LMNA
SCHEMBL5854536 0.82 PTGFR (0.38) RORCPPARDPDE4B
SCHEMBL5854254 0.82 PTGFR (0.38) RORCPPARDPDE4B
SCHEMBL9635181 0.82 SIGMAR1 (0.40) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL9634372 0.82 SIGMAR1 (0.39) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL10918844 0.81 MTNR1A (0.41)
SCHEMBL9862665 0.80 LMNA (0.42) PPARDLMNAMAPTHSD17B1RECQL
SCHEMBL5853638 0.78 PTGFR (0.35) RORCPPARDMAPTPDE4B
SCHEMBL10594963 0.76 ESR1 (0.38) PPARDLMNAMAPTHSD17B1RECQL

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-4833135-A Antioestrogenic phenol derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-05-23 US disclosed