SCHEMBL7217211

SCHEMBL7217211

CCOC(=O)c1cc2cc(O)c(OC)cc2n1S(=O)(=O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD2 Q9HC29 4/20 0.60
NOD1 Q9Y239 4/20 0.60
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
KDM4E B2RXH2 3/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSD17B2 P37059 1/20 0.43
GAA P10253 1/20 0.42
MTNR1B P49286 1/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40

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
SCHEMBL7216766 0.86 SRD5A1 (0.59) NOD2NOD1SMN1; SMN2NPC1RAB9A
SCHEMBL7222548 0.84 NOD2 (0.54) NOD2NOD1SMN1; SMN2NPC1RAB9A
SCHEMBL6858312 0.82 NOD2 (0.68) NOD2NOD1SMN1; SMN2KDM4ELMNA
SCHEMBL2542152 0.82 NOD2 (0.86) NOD2NOD1SMN1; SMN2KDM4ELMNA
SCHEMBL29500501 0.79 NOD2 (0.78) NOD2NOD1SMN1; SMN2KDM4ELMNA
SCHEMBL10003942 0.79 NOD2 (0.78) NOD2NOD1KDM4ELMNATSHR
SCHEMBL10004679 0.79 NOD2 (0.78) NOD2NOD1SMN1; SMN2KDM4ELMNA
SCHEMBL2347003 0.79 NOD2 (0.78) NOD2NOD1
SCHEMBL18537910 0.79 NOD2 (0.67) NOD2NOD1SMN1; SMN2KDM4ELMNA
SCHEMBL18332143 0.78 NOD2 (0.65) NOD2NOD1SMN1; SMN2KDM4ELMNA

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 NOD2 780/4885NOD1 339/4885SMN1; SMN2 3430/4885

“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.