SCHEMBL9083286

SCHEMBL9083286

CC(C)(C)c1ccc(Sc2ccc(C3(O)CCOCC3)s2)cc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P4HB P07237 1/20 0.32
RAB9A P51151 1/20 0.31
PRKDC P78527 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL9086298 0.82 ALOX5 (0.40)
SCHEMBL9086158 0.80
SCHEMBL9385364 0.78 MAPT (0.40) P4HBRAB9A
SCHEMBL9084888 0.77 PTPN11 (0.34)
SCHEMBL9086149 0.76
SCHEMBL9085038 0.70 ALOX5 (0.32)
SCHEMBL9086267 0.70 ALOX5 (0.32)
SCHEMBL9458464 0.70 ALOX5 (0.32)
SCHEMBL9458222 0.70 ALOX5 (0.36)
SCHEMBL9458422 0.68 HTR1A (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5484805-A LIPOXYGENASE INHIBITORS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1996-01-16 US disclosed
EP-0462812-B1 Pyran derivatives as inhibitors of 5-lipoxygenase ZENECA LTD (GB) 1995-12-06 EP disclosed
US-5359063-A Lipoxygenase inhibitor IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-10-25 US disclosed
US-5217978-A Lipoxygenase inhibitors IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-08 US disclosed
EP-0462812-A2 Pyran derivatives as inhibitors of 5-lipoxygenase ZENECA LIMITED (GB) 1991-12-27 EP disclosed