SCHEMBL7864094

SCHEMBL7864094

CC(C)CCCCCCc1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 4/20 0.49
▸ IGF1R P08069 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ AOC3 Q16853 1/20 0.46
▸ TAAR1 Q96RJ0 2/20 0.44
▸ SLC6A2 P23975 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ HDAC3 O15379 1/20 0.43
▸ HDAC4 P56524 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC7 Q8WUI4 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC10 Q969S8 1/20 0.43
▸ HDAC11 Q96DB2 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ HDAC9 Q9UKV0 1/20 0.43
▸ HDAC5 Q9UQL6 1/20 0.43
▸ PPARA Q07869 2/20 0.41
▸ PPARG P37231 1/20 0.41

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
SCHEMBL12968209 0.98 IGF1R (0.48) KCNH2IGF1RALOX15AOC3TAAR1
SCHEMBL14415406 0.92 MAOB (0.48) KCNH2IGF1RALOX15AOC3TAAR1
SCHEMBL9146183 0.92 AOC3 (0.48) KCNH2IGF1RALOX15AOC3TAAR1
Hydrogen Peroxide SCHEMBL29262757 0.85 GRIN2D (0.49) SLC6A2SLC6A3
SCHEMBL436099 0.83 AOC3 (0.52) KCNH2AOC3TAAR1SLC6A2SLC6A3
SCHEMBL1115439 0.82 IGF1R (0.61) KCNH2IGF1RALOX15AOC3TAAR1
SCHEMBL28966782 0.82 IGF1R (0.61) KCNH2IGF1RALOX15AOC3TAAR1
SCHEMBL2458605 0.82 IGF1R (0.48) IGF1RALOX15TAAR1SLC6A2SLC6A3
SCHEMBL10639385 0.82 IGF1R (0.48) IGF1RALOX15TAAR1SLC6A2SLC6A3
SCHEMBL9694171 0.82 IGF1R (0.48) IGF1RALOX15TAAR1SLC6A2SLC6A3

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
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-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
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
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