SCHEMBL17875568

SCHEMBL17875568

CC1(C)c2cccc(OP(c3cccc4c3OCC4)c3cccc4c3OCC4)c2Oc2c(OP(c3cccc4c3OCC4)c3cccc4c3OCC4)cccc21

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 2/20 0.41
PARP1 P09874 1/20 0.34
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
HRH1 P35367 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL16361847 0.81 DRD1 (0.57) DRD1PARP1
SCHEMBL16362111 0.79 PARP1 (0.39) PARP1SLC6A2SLC6A4HRH1SLC6A3
SCHEMBL17875572 0.73
SCHEMBL16362112 0.73 DRD1 (0.54) DRD1PARP1
SCHEMBL38662178 0.73 DRD1 (0.56) DRD1
SCHEMBL17875581 0.73 PARP1 (0.41) PARP1SLC6A2SLC6A4HRH1SLC6A3
SCHEMBL16362114 0.72 DRD1 (0.43) DRD1PARP1
SCHEMBL16362115 0.70 MAPT (0.38) PARP1SLC6A2SLC6A4HRH1SLC6A3
SCHEMBL16362118 0.68 DRD1 (0.42) DRD1PARP1
SCHEMBL17876422 0.68 PARP1 (0.47) PARP1SLC6A2SLC6A4HRH1SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9579641-B2 Aryl phosphines with fused ring ortho-alkoxy substitution DOW GLOBAL TECHNOLOGIES LLC (US) 2017-02-28 US disclosed
US-9579641-B2 Aryl phosphines with fused ring ortho-alkoxy substitution DOW GLOBAL TECHNOLOGIES LLC (US) 2017-02-28 US disclosed
US-20160184811-A1 ARYL PHOSPHINES WITH FUSED RING ORTHO-ALKOXY SUBSTITUTION DOW GLOBAL TECHNOLOGIES LLC (US) 2016-06-30 US disclosed
US-20160184811-A1 ARYL PHOSPHINES WITH FUSED RING ORTHO-ALKOXY SUBSTITUTION DOW GLOBAL TECHNOLOGIES LLC (US) 2016-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160184811-A1 ARYL PHOSPHINES WITH FUSED RING ORTHO-ALKOXY SUBSTITUTION ALK, PHOSPHO1, MPL DRD1 3012/4885PARP1 3058/4885SLC6A2 2602/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.