SCHEMBL11527348

SCHEMBL11527348

CC1=C(C2=CC(=O)OC2=O)C(C)C(c2ccccc2)=C1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.33
HK2 P52789 1/20 0.33
PDE4B Q07343 2/20 0.32
KMT2A Q03164 2/20 0.30
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL9359481 0.79 LMNA (0.33) PTGS2PDE4BCRHBPCRHR2MAPT
SCHEMBL6569636 0.71 ALDH1A1 (0.40) PTGS2PDE4BKMT2ANPC1MAPT
SCHEMBL210321 0.69 BACE1 (0.50) PDE4BKMT2AMEN1GAAMAPT
Benzene SCHEMBL28277789 0.69 BACE1 (0.50) PDE4BKMT2AMEN1GAAMAPT
Benzene SCHEMBL28133344 0.69 BACE1 (0.50) PDE4BKMT2AMEN1GAAMAPT
SCHEMBL28296080 0.67 BACE1 (0.48) PDE4BKMT2AMEN1GAAMAPT
SCHEMBL11726616 0.67 BACE1 (0.41) PTGS2HK2PDE4BKMT2AMEN1
SCHEMBL9467973 0.66 HSD17B3 (0.50) PTGS2MAPT
SCHEMBL28503247 0.65 PDCD1 (0.35) MAPT
Naphthalene SCHEMBL28134279 0.64 BACE1 (0.45) PDE4BKMT2AMEN1GAAMAPT

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-4140606-A Process for preparing a polymerizable (meth) acrylate oligomer SHOWA DENKO K.K. (JP) 1979-02-20 US disclosed
US-4010289-A METHOD OF MANUFACTURING SYNTHETIC RESIN FILM HAVING HIGH WRITABILITY AND PRINTABILITY SHOWA DENKO KABUSHIKI KAISHA (JA) 1977-03-01 US disclosed