SCHEMBL7864099

SCHEMBL7864099

C[C](C)CCCCCCCCCCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.64
RXFP1 Q9HBX9 1/20 0.64
HDAC1 Q13547 3/20 0.56
ALOX5 P09917 2/20 0.56
HDAC2 Q92769 2/20 0.56
FAAH O00519 3/20 0.55
CES1 P23141 3/20 0.55
SIGMAR1 Q99720 4/20 0.53
HDAC3 O15379 1/20 0.52
MAPK1 P28482 1/20 0.52
ADRA1A P35348 1/20 0.52
HDAC4 P56524 1/20 0.52
SLC6A3 Q01959 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52

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
SCHEMBL8123200 1.00 MAPT (0.64) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL8108303 1.00 MAPT (0.64) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL6164475 0.98 MAPT (0.61) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL1478009 0.91 HDAC1 (0.61) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL2162467 0.85 MAPT (0.62) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL11210743 0.85 MAPT (0.62) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL24340640 0.83 MAPT (0.71) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL547835 0.83 MAPT (0.71) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL9052095 0.83 MAPT (0.60) MAPTRXFP1HDAC1ALOX5HDAC2
SCHEMBL2632727 0.83 MAPT (0.71) MAPTRXFP1HDAC1ALOX5HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623608-B1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL PREPARATION CONTAINING THE SAME AS ACTIVE INGREDIENT TEIJIN LTD (JP) 2001-05-30 EP disclosed
EP-0632031-B1 CONDENSED BENZOXA RING COMPOUND, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LTD (JP) 2000-05-03 EP disclosed
EP-0546177-B1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LTD (JP) 1998-01-07 EP disclosed
US-5574061-A ANTILIPEMIC AGENT, ANTIATHEROSCLEROSIS, ACAT INHIBITOR TEIJIN LIMITED (JP) 1996-11-12 US disclosed
US-5496853-A FOR TREATING HYPERCHOLESTEROLEMIA TEIJIN LIMITED (JP) 1996-03-05 US disclosed
EP-0632031-A1 CONDENSED BENZOXA RING COMPOUND, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1995-01-04 EP disclosed
EP-0623608-A1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL PREPARATION CONTAINING THE SAME AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1994-11-09 EP disclosed
EP-0546177-A1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1993-06-16 EP disclosed