SCHEMBL7224541

SCHEMBL7224541

CCOC(=O)c1cc(O)n(CCN2CCOCC2)n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.47
RXFP1 Q9HBX9 3/20 0.44
RAD52 P43351 1/20 0.44
UHRF1 Q96T88 1/20 0.44
PIK3CA P42336 1/20 0.44
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 4/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 3/20 0.42
CASP7 P55210 1/20 0.42
CASP6 P55212 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL19615359 0.89 POLB (0.47) POLBRXFP1RAD52UHRF1PIK3CA
SCHEMBL23041613 0.86 POLB (0.46) POLBRXFP1RAD52UHRF1PIK3CA
SCHEMBL19615958 0.86 POLB (0.46) POLBRXFP1RAD52UHRF1PIK3CA
SCHEMBL7218733 0.85 ALDH1A1 (0.45) POLBRXFP1RAD52UHRF1PIK3CA
SCHEMBL19635528 0.79 POLB (0.47) POLBRXFP1RAD52UHRF1PIK3CA
SCHEMBL5560879 0.78 CYP1A2 (0.46) POLBKDM4EGAAKMT2A
SCHEMBL19635510 0.78 POLB (0.47) POLBRXFP1RAD52UHRF1PIK3CA
SCHEMBL22439702 0.77 NR5A2 (0.48) POLBPIK3CAALDH1A1KDM4EGAA
SCHEMBL15441448 0.77 TRPV4 (0.57) POLBALDH1A1KDM4EKMT2AMEN1
SCHEMBL23041539 0.77 POLB (0.46) POLBRXFP1RAD52UHRF1PIK3CA

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
US-6653304-B2 Antiarthritic agents; skin disorders; anticarcinogenic agents BRISTOL-MYERS SQUIBB CO. 2003-11-25 US disclosed
EP-1254115-A2 CANNABINOID RECEPTOR MODULATORS, THEIR PROCESSES OF PREPARATION, AND USE OF CANNABINOID RECEPTOR MODULATORS FOR TREATING RESPIRATORY AND NON-RESPIRATORY DISEASES Bristol-Myers Squibb Company (US) 2002-11-06 EP disclosed
US-20020119972-A1 Cannabinoid receptor modulators, their processes of preparation, and use of cannabinoid receptor modulators for treating respiratory and non-respiratory diseases BRISTOL-MYERS SQUIBB COMPANY 2002-08-29 US disclosed
WO-2001058869-A2 CANNABINOID RECEPTOR MODULATORS, THEIR PROCESSES OF PREPARATION, AND USE OF CANNABINOID RECEPTOR MODULATORS IN TREATING RESPIRATORY AND NON-RESPIRATORY DISEASES BRISTOL-MYERS SQUIBB COMPANY (US) 2001-08-16 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-20020119972-A1 Cannabinoid receptor modulators, their processes of preparation, and use of cannabinoid receptor modulators for treating respiratory and non-respiratory diseases CNR1, CNR2, GPR18 POLB 3977/4885RXFP1 192/4885RAD52 4068/4885

“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.