SCHEMBL7876990

SCHEMBL7876990

CC(C)(N)c1ccc(-c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.54
▸ GAA P10253 2/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ MAPT P10636 1/20 0.54
▸ MAOA P21397 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ MGAM O43451 1/20 0.52
▸ SI P14410 1/20 0.52
▸ MGAM2 Q2M2H8 1/20 0.52
▸ LMNA P02545 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ SLC6A2 P23975 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ PTGS2 P35354 1/20 0.51
▸ SLC6A3 Q01959 1/20 0.51
▸ HIF1A Q16665 1/20 0.51
▸ HDAC6 Q9UBN7 1/20 0.51
▸ GSTP1 P09211 2/20 0.51

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
SCHEMBL7899077 0.95 MAOB (0.59) MAOBGAARAB9ASMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL7877078 0.93 MAOB (0.59) MAOBGAARAB9ASMN1; SMN2MAPT
SCHEMBL6059276 0.87 LMNA (0.55) MAOBGAARAB9ASMN1; SMN2MAPT
SCHEMBL12732314 0.87 APP (0.63) MAOBGAARAB9ASMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL7406333 0.83 MAOB (0.59) MAOBGAARAB9ASMN1; SMN2MAPT
SCHEMBL197017 0.82 LMNA (0.72) MAOBGAARAB9ASMN1; SMN2MAPT
SCHEMBL17024339 0.82 LMNA (0.58) MAOBGAARAB9ASMN1; SMN2MAPT
SCHEMBL13439802 0.82 APP (0.66) MAOBGAASMN1; SMN2LMNACYP1A2
SCHEMBL10013799 0.81 LMNA (0.60) MAOBGAARAB9ASMN1; SMN2MAPT
SCHEMBL419050 0.81 APP (0.69) MAOBGAARAB9ASMN1; SMN2MAPT

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
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
Send feedback