SCHEMBL7959844

SCHEMBL7959844

COc1ccc(C)c(C(O)C2CCCCC2=O)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
ALDH1A1 P00352 4/20 0.45
MAPT P10636 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
POLB P06746 2/20 0.38
LMNA P02545 2/20 0.38
USP2 O75604 1/20 0.38
CYP2D6 P10635 1/20 0.37
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PTGS1 P23219 1/20 0.36
MAOA P21397 1/20 0.36
KDM4E B2RXH2 2/20 0.35
GAA P10253 1/20 0.34

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
SCHEMBL3485806 0.80 ALDH1A1 (0.55) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL14292323 0.80 ALDH1A1 (0.55) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL13254545 0.80 ALDH1A1 (0.55) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL8065500 0.78 MAPT (0.56) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL8056693 0.78 MAPT (0.56) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7959988 0.77 MAPT (0.52) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7490400 0.77 MAPT (0.55) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7483180 0.77 MAPT (0.55) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7960098 0.76 MAPT (0.47) MAPK1ALDH1A1MAPTPOLBLMNA
SCHEMBL7961084 0.75 MAPT (0.47) MAPK1ALDH1A1MAPTMEN1KMT2A

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-6245790-B1 ANTIINFLAMMATORY AGENTS; GASTROINTESTINAL DISORDERS; SKN DISORDERS; BONE DISORDERS; MUSCLE RELAXANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-06-12 US disclosed
EP-0989975-A1 OXAZOLE COMPOUNDS USEFUL AS PGE2 AGONISTS AND ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed
WO-2000016760-A2 NEW USE OF PROSTAGLANDIN E2 ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-03-30 WO disclosed
WO-1998055468-A1 OXAZOLE COMPOUNDS USEFUL AS PGE2 AGONISTS AND ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-10 WO disclosed