SCHEMBL6554875

SCHEMBL6554875

CONC(C)(C)C(=O)OP(=O)(Cl)Oc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
KCNN4 O15554 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
BTN3A1 O00481 3/20 0.34
HPGD P15428 1/20 0.33
ELANE P08246 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL4268814 0.83 ELANE (0.40) ALDH1A1HTTKDM4EELANE
SCHEMBL1811808 0.77 RAB9A (0.46) ALDH1A1HTTKDM4EL3MBTL1HPGD
SCHEMBL441596 0.74 KCNN4 (0.42) SRCALDH1A1PKMHTTKCNN4
SCHEMBL7032414 0.73 BTN3A1 (0.42) SRCPKMHTTL3MBTL1BTN3A1
SCHEMBL5996997 0.72 BTN3A1 (0.40) SRCPKMHTTLMNAL3MBTL1
SCHEMBL643837 0.72 BTN3A1 (0.40) SRCPKMHTTLMNAL3MBTL1
SCHEMBL2012770 0.70 ELANE (0.40) SRCALDH1A1PKMHTTKDM4E
SCHEMBL2012767 0.70 ELANE (0.40) SRCALDH1A1PKMHTTKDM4E
SCHEMBL17902756 0.70 SRC (0.44) SRCALDH1A1PKMHTTKDM4E
SCHEMBL11433980 0.69 SRC (0.50) SRCALDH1A1PKMHTTKDM4E

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-1235833-B1 ANALOGS OF (1S, CIS)-4-(2-AMINO-9H-PURIN-9-YL)-2-CYCLOPENTENE-1-METHANOL AS ANTIVIRAL GLAXO GROUP LTD (GB) 2004-02-25 EP disclosed
US-20030040506-A1 Analogs of (1s,cis)-4-(2-amino-9h-purin -9-yl) -2-Cyclopentene-1-methanol as antiviral SMITHKLINE BEECHAM CORPORATION 2003-02-27 US disclosed
EP-1235833-A1 ANALOGS OF (1S, CIS)-4-(2-AMINO-9H-PURIN-9-YL)-2-CYCLOPENTENE-1-METHANOL AS ANTIVIRAL GLAXO GROUP LIMITED (GB) 2002-09-04 EP disclosed
WO-2001042256-A1 ANALOGS OF (1S, cis)-4-(2-AMINO-9H-PURIN-9-YL)-2-CYCLOPENTENE-1-METHANOL AS ANTIVIRAL GLAXO GROUP LIMITED (GB) 2001-06-14 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-20030040506-A1 Analogs of (1s,cis)-4-(2-amino-9h-purin -9-yl) -2-Cyclopentene-1-methanol as antiviral MAVS, ZC3HAV1, HAVCR2 SRC 3486/4885ALDH1A1 510/4885PKM 4107/4885

“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.