SCHEMBL7303445

SCHEMBL7303445

[c]1ccc(COCC2CCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
CTSK P43235 1/20 0.41
NAAA Q02083 1/20 0.38

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
SCHEMBL9685940 0.96 CTSL (0.41) CTSLCTSBCTSKNAAA
SCHEMBL7294313 0.95 NAAA (0.40) CTSLCTSBCTSKNAAA
SCHEMBL6347240 0.92 CTSL (0.43) CTSLCTSBCTSKNAAA
SCHEMBL9687339 0.91 CTSL (0.35) CTSLCTSBCTSKNAAA
SCHEMBL7328275 0.88 CTSL (0.35) CTSLCTSBCTSKNAAA
SCHEMBL7321608 0.86 NAAA (0.35) CTSLCTSBCTSKNAAA
SCHEMBL7323296 0.84 CTSL (0.37) CTSLCTSBCTSKNAAA
SCHEMBL7303225 0.82 ADRB1 (0.41)
SCHEMBL6649338 0.81 TSHR (0.54) CTSLCTSBCTSKNAAA
SCHEMBL7331550 0.81 DRD2 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5135932-A 2-HYDROXYPROPYLAMINO-ALKYL-BENZIMIDAZOLY-5-YL DERIVATIVES AND THEIR USE IN THE TREATMENT OF HEART DISEASE DR. KARL THOMAE GMBH (DE) 1992-08-04 US disclosed
EP-0400519-A1 2-Hydroxy-n-propylamines, medicaments containing these compounds and method for preparing them Dr. Karl Thomae GmbH (DE) 1990-12-05 EP disclosed