SCHEMBL7023448

SCHEMBL7023448

CON[C@@H](C)C(=O)OP(=O)(Cl)Oc1ccc(I)cc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.32
P2RX3 P56373 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
F10 P00742 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL10004082 0.91 CA1 (0.38) SMN1; SMN2NPC1HPGDRAB9A
SCHEMBL1811991 0.88 HPGD (0.39) NPC1ALDH1A1HPGD
SCHEMBL1807789 0.87 CYP1A2 (0.37) SMN1; SMN2NPC1ALDH1A1HPGDRAB9A
SCHEMBL2008560 0.87 LMNA (0.41) SMN1; SMN2ALDH1A1RAB9A
SCHEMBL2008561 0.87 LMNA (0.41) SMN1; SMN2ALDH1A1RAB9A
SCHEMBL643837 0.86 BTN3A1 (0.40) HPGD
SCHEMBL5996997 0.86 BTN3A1 (0.40) HPGD
SCHEMBL1811770 0.84 ALDH1A1 (0.36) ALDH1A1
SCHEMBL1807498 0.84 CA1 (0.47) SMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL7027968 0.75 BTN3A1 (0.40) ALDH1A1

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
EP-1117669-B1 ANTIVIRAL PURINE DERIVATIVES UNIV CARDIFF (GB) 2003-01-29 EP disclosed
US-20010031745-A1 Antiviral purine derivatives UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2001-10-18 US disclosed
EP-1117669-A1 ANTIVIRAL PURINE DERIVATIVES UNIVERSITY COLLEGE CARDIFF CONSULTANTS LTD. (GB) 2001-07-25 EP disclosed
WO-2000018775-A1 ANTIVIRAL PURINE DERIVATIVES UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2000-04-06 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-20010031745-A1 Antiviral purine derivatives PNP, TYMP, MTAP APP 912/4885P2RX3 377/4885SMN1; SMN2 1420/4885

“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.