SCHEMBL8395653

SCHEMBL8395653

[O]C(=O)OCCC1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.39
HPGD P15428 1/20 0.38
LMNA P02545 1/20 0.37
NAAA Q02083 5/20 0.36
ASAH1 Q13510 1/20 0.36
NFE2L2 Q16236 1/20 0.35
FKBP1A P62942 1/20 0.35

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
SCHEMBL8391120 0.98 EPHX1 (0.46) EPHX1SMN1; SMN2HPGDLMNANAAA
SCHEMBL8391417 0.98 EPHX1 (0.46) EPHX1SMN1; SMN2HPGDLMNANAAA
SCHEMBL8394719 0.95 EPHX1 (0.40) EPHX1SMN1; SMN2HPGDLMNANAAA
SCHEMBL8393821 0.91
SCHEMBL9040028 0.87 EPHX1 (0.53) EPHX1SMN1; SMN2NAAAASAH1FKBP1A
SCHEMBL8394197 0.85 EPHX1 (0.56) EPHX1SMN1; SMN2NAAAASAH1FKBP1A
SCHEMBL8395994 0.85 EPHX1 (0.56) EPHX1SMN1; SMN2NAAAASAH1FKBP1A
SCHEMBL8393588 0.83 EPHX1 (0.49) EPHX1SMN1; SMN2NAAAASAH1FKBP1A
SCHEMBL8395658 0.82 EPHX1 (0.43) EPHX1SMN1; SMN2HPGDLMNANAAA
SCHEMBL8393778 0.80 EPHX1 (0.42) EPHX1SMN1; SMN2HPGDLMNANAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed
EP-0392317-B1 Benzimidazoles, drugs containing these compounds and process for their preparation THOMAE GMBH DR K (DE) 1996-01-03 EP disclosed
EP-0392317-A2 Benzimidazoles, drugs containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1990-10-17 EP disclosed