SCHEMBL7026588

SCHEMBL7026588

CCCN[C@@H](C)C(=O)OP(=O)(Cl)Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.41
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
PRTN3 P24158 2/20 0.41
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
ELANE P08246 2/20 0.39
BTN3A1 O00481 6/20 0.39
ANPEP P15144 1/20 0.37
LAP3 P28838 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL7027694 0.93 SMN1; SMN2 (0.41) PRTN3HPGDELANEBTN3A1SMN1; SMN2
SCHEMBL7027248 0.91 ZDHHC2 (0.42) PRTN3ELANEBTN3A1SMN1; SMN2
SCHEMBL15721086 0.85 KMT2A (0.44) PRTN3LMNAMAPTHPGDELANE
SCHEMBL7027815 0.82 PRTN3 (0.39) PRTN3LMNAELANEBTN3A1ANPEP
SCHEMBL5857844 0.82 ELANE (0.40) PRTN3ELANEBTN3A1ANPEPLAP3
SCHEMBL873273 0.82 BTN3A1 (0.41) PRTN3LMNAELANEBTN3A1ANPEP
SCHEMBL3971351 0.82 BTN3A1 (0.41) PRTN3LMNAELANEBTN3A1ANPEP
SCHEMBL7023266 0.81 ELANE (0.40) PRTN3ELANEBTN3A1ANPEPLAP3
SCHEMBL3970115 0.81 TSHR (0.39) PRTN3ELANEBTN3A1
SCHEMBL3970116 0.81 TSHR (0.39) PRTN3ELANEBTN3A1

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 PGR 2265/4885SCN1A 4433/4885SCN2A 4647/4885

“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.