SCHEMBL7875162

SCHEMBL7875162

Clc1ccc(OCCNCCCCCn2ccnc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 3/20 0.60
PKM P14618 1/20 0.58
KDM4E B2RXH2 1/20 0.57
LMNA P02545 1/20 0.57
QPCT Q16769 1/20 0.55

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
Hydrochloric Acid SCHEMBL7873793 0.98 NOS1 (0.57) NOS1PKMKDM4ELMNAQPCT
Hydrochloric Acid SCHEMBL7873791 0.98 NOS1 (0.57) NOS1PKMKDM4ELMNAQPCT
SCHEMBL7868580 0.95 PKM (0.64) NOS1PKMKDM4ELMNAQPCT
Hydrochloric Acid SCHEMBL7873875 0.94 PKM (0.63) NOS1PKMKDM4ELMNAQPCT
SCHEMBL7875030 0.94 PKM (0.65) NOS1PKMKDM4ELMNAQPCT
SCHEMBL7868645 0.82 CACNA1B (0.61) NOS1KDM4ELMNAQPCT
SCHEMBL7876962 0.82 TBXAS1 (0.69) NOS1KDM4ELMNAQPCT
Hydrochloric Acid SCHEMBL7876983 0.81 CACNA1B (0.60) NOS1KDM4ELMNAQPCT
Hydrochloric Acid SCHEMBL7879599 0.81 MEN1 (0.59) NOS1KDM4ELMNAQPCT
SCHEMBL13246341 0.81 QPCT (0.76) NOS1KDM4ELMNAQPCT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995000493-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS KNOLL AG (DE) 1995-01-05 WO claimed
US-6326500-B1 ANTIINFLAMMATORY AGENTS; ANTIALLERGENS ABBOTT LABORATORIES 2001-12-04 US disclosed
US-6215001-B1 ANTIINFLAMMATORY AGENTS, ANTIASTHMATICS, AND ANTIALLERGENS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 2001-04-10 US disclosed
US-6031109-A Phenoxy-, phenylthio-, benzoyl-alkyleneaminoalkylene-imidazole derivatives as therapeutic agents KNOLL AKTIENGESELLSCHAFT (DE) 2000-02-29 US disclosed
US-5780642-A NON-STEROIDAL ANTIINFLAMMATORY AGENT WHICH BLOCKS RELEASE OF ARACHIDONIC ACID FROM PHOSPHOLIPIDS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 1998-07-14 US disclosed
WO-1995000493-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS KNOLL AG (DE) 1995-01-05 WO disclosed