SCHEMBL11233429

SCHEMBL11233429

Cc1cccc(Cl)c1Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 2/20 0.45
DPP4 P27487 1/20 0.44
KDM4E B2RXH2 2/20 0.44
LTA4H P09960 2/20 0.42
TSHR P16473 1/20 0.42
HTR1A P08908 2/20 0.41
SLC6A2 P23975 1/20 0.41
NPBWR1 P48145 4/20 0.40
MCHR1 Q99705 2/20 0.40
MAPT P10636 3/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LPAR1 Q92633 1/20 0.38
LPAR5 Q9H1C0 1/20 0.38
KMT2A Q03164 2/20 0.38
GLA P06280 1/20 0.38
HSP90AA1 P07900 1/20 0.38
PGR P06401 1/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL9487846 0.85 LTA4H (0.52) KDM4ELTA4HTSHRMAPTL3MBTL1
SCHEMBL9645022 0.85 LTA4H (0.52) RHEBDPP4KDM4ELTA4HTSHR
SCHEMBL4802709 0.78 RHEB (0.47) RHEBDPP4KDM4ELTA4HTSHR
SCHEMBL15869671 0.78 KDM4E (0.58) KDM4EHTR1AMAPTGAARAB9A
SCHEMBL1345933 0.78 LTA4H (0.44) DPP4LTA4HTSHRSLC6A2GAA
SCHEMBL3784924 0.78 DPP4 (0.59) RHEBDPP4LTA4HTSHRMAPT
SCHEMBL19086333 0.76 LTA4H (0.42) KDM4ELTA4HTSHRMAPTL3MBTL1
SCHEMBL981249 0.76 TRPA1 (0.45) KDM4ELTA4HTSHRMAPTL3MBTL1
SCHEMBL11235395 0.76 ACHE (0.48) KDM4ELTA4HTSHRHTR1ASLC6A2
SCHEMBL11313504 0.76 ALDH1A1 (0.48) KDM4ELTA4HTSHRMAPTL3MBTL1

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-4331821-A ULTRAVIOLET RADIATION OF A VAPORIZED ALKYLBENZEN AND HALOGEN GAS MIXTURE BAYER AKTIENGESELLSCHAFT (DE) 1982-05-25 US disclosed