SCHEMBL8768246

SCHEMBL8768246

Clc1ccc(OP(Oc2ccccc2)Oc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
DRD3 P35462 1/20 0.44
CYP1A2 P05177 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
SCN4A P35499 2/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PPARG P37231 2/20 0.40
PGR P06401 2/20 0.40
PPARA Q07869 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 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
SCHEMBL593487 0.90 LMNA (0.47) DRD2DRD4DRD3CYP1A2TDP1
Hydrochloric Acid SCHEMBL11098692 0.87 LMNA (0.44) DRD2DRD4DRD3CYP1A2TDP1
SCHEMBL7771305 0.87 LMNA (0.44) DRD2DRD4DRD3CYP1A2TDP1
SCHEMBL11550421 0.86 TDP1 (0.41) TSHRDRD2DRD4DRD3CYP1A2
SCHEMBL8648037 0.85 LTA4H (0.45) TSHRTDP1KMT2ALMNAMAOA
SCHEMBL10860055 0.85 LTA4H (0.45) TSHRTDP1KMT2ALMNAMAOA
SCHEMBL13289 0.84 LTA4H (0.50) TSHRTDP1KMT2ACYP3A4LMNA
SCHEMBL11875556 0.82 LTA4H (0.43) TSHRTDP1KMT2ALMNAMAOA
SCHEMBL8646529 0.82 LTA4H (0.43) TSHRTDP1KMT2ALMNAMAOA
SCHEMBL8662152 0.82 LTA4H (0.47) TSHRTDP1KMT2ACYP3A4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0306094-B1 PROCESS FOR THE HYDROFORMYLATION OF CERTAIN ACRYLIC ACID DERIVATIVES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-01-29 EP claimed
EP-0306094-A2 Process for the hydroformylation of certain acrylic acid derivatives SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-03-08 EP claimed
EP-0791616-A1 Process for producing polysuccinimide and use of said compound MITSUBISHI CHEMICAL CORPORATION (JP) 1997-08-27 EP disclosed
EP-0306094-B1 PROCESS FOR THE HYDROFORMYLATION OF CERTAIN ACRYLIC ACID DERIVATIVES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-01-29 EP disclosed
EP-0306094-A2 Process for the hydroformylation of certain acrylic acid derivatives SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-03-08 EP disclosed