SCHEMBL9816698

SCHEMBL9816698

c1ccc(Cc2c(Oc3ccccc3)cccc2Oc2cccc(Oc3ccccc3)c2Cc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.50
GAA P10253 2/20 0.47
LMNA P02545 2/20 0.47
KMT2A Q03164 2/20 0.47
HRH1 P35367 1/20 0.44
LTA4H P09960 3/20 0.44
TSHR P16473 1/20 0.44
CALM1 P0DP23 1/20 0.44
SLC6A4 P31645 2/20 0.43
RIPK1 Q13546 1/20 0.43
SLC6A2 P23975 1/20 0.43
SRD5A2 P31213 1/20 0.42
TTR P02766 1/20 0.42
HTR2A P28223 1/20 0.40
CTNNB1 P35222 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL31443510 0.79 LMNA (0.49) DPP4GAALMNAKMT2AHRH1
SCHEMBL28180000 0.79 HRH1 (0.58) GAALMNAKMT2AHRH1TSHR
SCHEMBL7669757 0.79 CALM1 (0.44) GAALMNAKMT2ALTA4HTSHR
SCHEMBL7033288 0.79 HPGD (0.49) LMNAHRH1TSHRCALM1HTR2A
SCHEMBL9419588 0.79 TTR (0.42) DPP4GAALMNAKMT2AHRH1
SCHEMBL9235387 0.78 L3MBTL1 (0.46) LMNAHRH1LTA4HTSHRCALM1
Phosphine SCHEMBL28179254 0.78 HRH1 (0.56) GAALMNAKMT2AHRH1TSHR
SCHEMBL393291 0.78 CALM1 (0.42) DPP4GAALMNALTA4HCALM1
SCHEMBL3728677 0.77 LTA4H (0.52) GAALTA4HCALM1KDM4EALDH1A1
SCHEMBL9264065 0.77 LTA4H (0.65) DPP4GAALMNAKMT2AHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0202838-B1 PROCESS FOR PRODUCTION OF M-PHENOXYBENZYL ALCOHOL MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-09-18 EP disclosed
US-4694110-A Process for production of m-phenoxybenzyl alcohol MITSUI TOATSU CHEMICALS, INC. (JP) 1987-09-15 US disclosed
EP-0202838-A2 Process for production of m-phenoxybenzyl alcohol MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-11-26 EP disclosed