SCHEMBL9700271

SCHEMBL9700271

Oc1ccc(C2=CC(Cc3ccccc3)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 1/20 0.42
BCL2L1 Q07817 1/20 0.42
CYP26A1 O43174 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
CYP2C19 P33261 1/20 0.38
PTGS2 P35354 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HIF1A Q16665 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
MMP2 P08253 1/20 0.37
GRIN2D O15399 2/20 0.37
GRIN3B O60391 2/20 0.37
ADRA1D P25100 2/20 0.37

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
SCHEMBL28554811 0.68 CYP26A1 (0.41) MMP3BCL2L1CYP26A1FNTAFNTB
SCHEMBL29077882 0.66 NOS1 (0.41)
SCHEMBL9700293 0.66 ALDH1A1 (0.37) LMNA
SCHEMBL10455047 0.65 ESR1 (0.67) MMP3BCL2L1FNTAFNTBESR1
SCHEMBL8056670 0.65 ESR1 (0.67) MMP3BCL2L1FNTAFNTBLMNA
SCHEMBL7565494 0.64 GBA1 (0.45) SLC6A2SLC6A3
SCHEMBL9323596 0.63 TSHR (0.68) MMP3BCL2L1FNTAFNTBLMNA
Benzyl Alcohol SCHEMBL28229622 0.63 MMP3 (0.68) MMP3BCL2L1FNTAFNTBLMNA
SCHEMBL7039574 0.63 MMP3 (0.68) MMP3BCL2L1FNTAFNTBLMNA
SCHEMBL7865208 0.62 MMP3 (1.00) MMP3BCL2L1LMNAESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5120884-A Preparation of hydroxy arylcyclobutenes THE DOW CHEMICAL COMPANY (US) 1992-06-09 US disclosed