SCHEMBL5060283

SCHEMBL5060283

O=C(O)C(c1ccccc1)C(F)P(=O)(O)CC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.43
CYP2D6 P10635 1/20 0.41
BCHE P06276 6/20 0.40
EPHX1 P07099 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CCR1 P32246 1/20 0.37
OPRK1 P41145 1/20 0.37
KDM4E B2RXH2 1/20 0.36
DPEP1 P16444 1/20 0.36
ACP3 P15309 1/20 0.36
CHRM3 P20309 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
SCHEMBL5057977 0.73 CYP1A2 (0.42) EPHX2BCHECCR1OPRK1KDM4E
SCHEMBL5060061 0.72 CNR1 (0.43) EPHX2BCHEEPHX1CCR1OPRK1
SCHEMBL5059817 0.72 KLK7 (0.40) EPHX2BCHECCR1OPRK1KDM4E
SCHEMBL9595984 0.72 EPHX2 (0.49) EPHX2BCHENPC1RAB9ACCR1
SCHEMBL5051234 0.70 GAA (0.47) CYP2D6
SCHEMBL5060077 0.69 CYP2D6 (0.42) EPHX2CYP2D6KDM4ECHRM3
SCHEMBL10901117 0.69 MMP2 (0.41)
SCHEMBL9595977 0.68 RAB9A (0.49) EPHX2BCHENPC1RAB9ACCR1
SCHEMBL8058593 0.68 BCHE (0.44) EPHX2CYP2D6BCHENPC1RAB9A
SCHEMBL10955580 0.66 CYP2D6 (0.53) CYP2D6EPHX1RAB9ACHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0994707-A4 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARM INC (US) 2001-11-14 EP claimed
EP-0994707-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 2000-04-26 EP claimed
WO-1998053812-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1998-12-03 WO claimed
US-20080311037-A1 Compounds which bind PSMA and uses thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2008-12-18 US disclosed
WO-2006093991-A1 COMPOUNDS WHICH BIND PSMA AND USES THEREOF THE CLEVELAND CLINIC FOUNDATION (US) 2006-09-08 WO disclosed
EP-0994707-A4 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARM INC (US) 2001-11-14 EP disclosed
EP-0994707-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 2000-04-26 EP disclosed
US-6025345-A NOVEL PHOSPHONATE DERIVATIVES, HYDROXYPHOSPHINYL DERIVATIVES, AND PHOSPHORAMIDATE DERIVATIVES THAT INHIBIT N-ACETYLATED .ALPHA.-LINKED ACIDIC DIPEPTIDASE (NAALADASE) ENZYME ACTIVITY, GUILFORD PHARMACEUTICALS INC. (US) 2000-02-15 US disclosed
WO-1998053812-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1998-12-03 WO 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-20080311037-A1 Compounds which bind PSMA and uses thereof FOLH1, PSMA1, BPHL EPHX2 2275/4885CYP2D6 2882/4885BCHE 1072/4885

“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.