SCHEMBL7284909

SCHEMBL7284909

CCCOCCCCOc1c[c]ccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.41
KCNA3 P22001 1/20 0.39
TSHR P16473 2/20 0.38
KMT2A Q03164 1/20 0.37
NR5A1 Q13285 1/20 0.35
RECQL P46063 1/20 0.35
RARB P10826 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
MLNR O43193 1/20 0.33
NR1I2 O75469 1/20 0.33

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
SCHEMBL7370014 0.90 LTA4H (0.46) LTA4HKCNA3TSHRKMT2ANR5A1
SCHEMBL10710506 0.90 LTA4H (0.47) LTA4HTSHRKMT2ANR5A1RECQL
SCHEMBL921651 0.88 SMN1; SMN2 (0.41) LTA4HKCNA3TSHRHDAC3HDAC4
SCHEMBL532917 0.88 LTA4H (0.53) LTA4HKCNA3TSHRNR5A1MLNR
SCHEMBL129009 0.88 KMT2A (0.42) LTA4HKCNA3TSHRKMT2A
SCHEMBL921650 0.87 SMN1; SMN2 (0.40) LTA4HKCNA3TSHRNR5A1HDAC3
SCHEMBL920469 0.87 SMN1; SMN2 (0.40) LTA4HKCNA3TSHRNR5A1HDAC3
SCHEMBL1712440 0.87 SMN1; SMN2 (0.40) LTA4HKCNA3TSHRNR5A1HDAC3
SCHEMBL5014110 0.86 LTA4H (0.51) LTA4HKCNA3TSHRNR5A1MLNR
SCHEMBL533346 0.86 LTA4H (0.51) LTA4HKCNA3TSHRNR5A1MLNR

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-5137889-A Hypotensive agents; coronary vasodilators; calcium antagonists; antiinflammatory agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-08-11 US disclosed
US-5034395-A Hypotensive agents, carboxylated dihydropyridines OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-07-23 US disclosed
US-4795814-A CORONARY VASODILATORS, HYPOTENSIVE AGENTS, ANTIINFLAMMATORY AGENTS, ANTITUMOR AGENTTS, ENZYME INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-01-03 US disclosed
EP-0173126-A1 Process for preparing novel dihydropyridine derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-03-05 EP disclosed
EP-0145434-A2 Novel dihydropyridine derivatives and process for preparing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-06-19 EP disclosed