SCHEMBL8496147

SCHEMBL8496147

CCCc1c(O)cc(O)c(-c2ccc(F)cc2)c1CC

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 8/20 0.47
▸ USP7 Q93009 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ XBP1 P17861 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ LTB4R Q15722 7/20 0.37
▸ LTB4R2 Q9NPC1 7/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL8492678 0.77 LTB4R (0.45) LTB4RLTB4R2
SCHEMBL11881502 0.69 NPC1 (0.43) KDM4EMAPK1HTT
SCHEMBL9744064 0.69 NPC1 (0.48) GCGRLMNAMAPTXBP1HIF1A
SCHEMBL2662506 0.69 GCGR (0.51) GCGR
SCHEMBL4386879 0.69 CNR2 (0.42) LTB4RLTB4R2TP53
SCHEMBL919514 0.68 PPARG (0.53) —
SCHEMBL6469970 0.68 PPARG (0.53) —
SCHEMBL5208612 0.67 ALOX5 (0.57) GCGRLMNAMAPTXBP1HIF1A
SCHEMBL2648377 0.67 GCGR (0.73) GCGR
SCHEMBL4387388 0.67 ESR1 (0.44) GCGRUSP7KDM4EHTTHSD17B10

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5914340-A ADMINISTERING TO TREAT OR INHIBIT SKIN DISORDERS SUCH AS ATOPIC DERMATITIS, CONTACT DERMATITIS, BULLOUS PEMPHIGOID, URTICARIA DISEASES, PETYRIASIS RUBRA PILARIS AND DYSHEDROSIS ELI LILLY AND COMPANY (US) 1999-06-22 — — US claimed
US-5910505-A Leukotriene antagonists for use in the treatment or inhibition of oral squamous cell carcinoma ELI LILLY AND COMPANY (US) 1999-06-08 — — US claimed
US-5817684-A ADMINISTERING AN AROMATIC ALCOHOL COMPOUND ELI LILLY AND COMPANY (US) 1998-10-06 — — US claimed
US-5914340-A ADMINISTERING TO TREAT OR INHIBIT SKIN DISORDERS SUCH AS ATOPIC DERMATITIS, CONTACT DERMATITIS, BULLOUS PEMPHIGOID, URTICARIA DISEASES, PETYRIASIS RUBRA PILARIS AND DYSHEDROSIS ELI LILLY AND COMPANY (US) 1999-06-22 — — US disclosed
US-5910505-A Leukotriene antagonists for use in the treatment or inhibition of oral squamous cell carcinoma ELI LILLY AND COMPANY (US) 1999-06-08 — — US disclosed
US-5817684-A ADMINISTERING AN AROMATIC ALCOHOL COMPOUND ELI LILLY AND COMPANY (US) 1998-10-06 — — US disclosed
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