SCHEMBL7868580

SCHEMBL7868580

Clc1ccc(OCCNCCCn2ccnc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.64
QPCT Q16769 1/20 0.58
ADAMTS5 Q9UNA0 1/20 0.57
NOS1 P29475 2/20 0.56
LMNA P02545 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
ATM Q13315 1/20 0.56
KDM4E B2RXH2 1/20 0.56
DRD4 P21917 2/20 0.56
DRD2 P14416 1/20 0.56
DRD3 P35462 1/20 0.56

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 SCHEMBL7873875 0.99 PKM (0.63) PKMQPCTADAMTS5NOS1LMNA
SCHEMBL7875030 0.99 PKM (0.65) PKMQPCTADAMTS5NOS1LMNA
SCHEMBL7875162 0.95 NOS1 (0.60) PKMQPCTNOS1LMNAKDM4E
Hydrochloric Acid SCHEMBL7873791 0.93 NOS1 (0.57) PKMQPCTNOS1LMNAMEN1
Hydrochloric Acid SCHEMBL7873793 0.93 NOS1 (0.57) PKMQPCTNOS1LMNAMEN1
SCHEMBL7868645 0.87 CACNA1B (0.61) QPCTNOS1LMNAMEN1KMT2A
SCHEMBL7876962 0.87 TBXAS1 (0.69) QPCTNOS1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL7879599 0.86 MEN1 (0.59) QPCTNOS1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL7876983 0.86 CACNA1B (0.60) QPCTNOS1LMNAMEN1KMT2A
SCHEMBL7873899 0.85 TBXAS1 (0.72) QPCTNOS1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0705251-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS Knoll AG (DE) 1996-04-10 EP claimed
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
EP-0705251-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS Knoll AG (DE) 1996-04-10 EP disclosed
WO-1995000493-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS KNOLL AG (DE) 1995-01-05 WO disclosed