SCHEMBL6401883

SCHEMBL6401883

O=P(O)(O)Sc1ccc(O)cc1CCCc1cccc(O)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 2/20 0.45
MGLL Q99685 1/20 0.43
HDAC6 Q9UBN7 1/20 0.42
DRD2 P14416 1/20 0.41
DRD1 P21728 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
AKR1B10 O60218 1/20 0.40
AKR1B1 P15121 1/20 0.40
MIF P14174 1/20 0.39
IDO1 P14902 1/20 0.39
CHRM2 P08172 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
OPRK1 P41145 1/20 0.38
SLC6A5 Q9Y345 1/20 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
SCHEMBL6396039 0.97 MGLL (0.46) CALM1MGLLHDAC6DRD2DRD1
SCHEMBL6395985 0.92 DRD2 (0.44) CALM1MGLLDRD2DRD1TAAR1
SCHEMBL6401455 0.90 CALM1 (0.44) CALM1MGLLHDAC6DRD2DRD1
SCHEMBL6394285 0.89 SLC28A3 (0.41) CALM1MGLLAKR1B10AKR1B1CHRM2
SCHEMBL6395752 0.88 MGLL (0.45) CALM1MGLLHDAC6DRD2DRD1
SCHEMBL6399251 0.86 IGF1R (0.42) MGLLAKR1B10AKR1B1CHRM2CHRM1
SCHEMBL6397454 0.82 DRD2 (0.42) CALM1MGLLDRD2DRD1TAAR1
SCHEMBL6397091 0.81 MGLL (0.41) CALM1MGLLHDAC6DRD2DRD1
SCHEMBL6404250 0.81 SLC28A3 (0.44) CALM1MGLLHDAC6DRD2DRD1
SCHEMBL6402235 0.81 MGLL (0.39) CALM1MGLLHDAC6DRD2DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050187195-A1 Inhibition of intestinal apical membrane Na/phosphate co-transportation in humans PEERCE BRIAN E (US) 2005-08-25 US disclosed
US-20030162753-A1 Inhibition of intestinal apical membrane Na/phosphate co-transportation in humans BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2003-08-28 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 (2 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-20050187195-A1 Inhibition of intestinal apical membrane Na/phosphate co-transportation in humans SLC34A3, SLC34A1, SLC34A2 CALM1 2071/4885MGLL 3457/4885HDAC6 4653/4885
US-20030162753-A1 Inhibition of intestinal apical membrane Na/phosphate co-transportation in humans SLC34A3, SLC34A1, SLC34A2 CALM1 2071/4885MGLL 3457/4885HDAC6 4653/4885

“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.