SCHEMBL2469201

SCHEMBL2469201

[c]1ccc(OCOC2CCCC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.36
ATF4 P18848 2/20 0.33
KDM4E B2RXH2 4/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
NFE2L2 Q16236 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL7865505 0.84 HPGD (0.46) HPGDATF4KDM4ECYP1A2CYP2D6
SCHEMBL321332 0.84 HPGD (0.47) HPGDKDM4ECYP1A2CYP2D6CYP2C19
SCHEMBL6268154 0.79 VCP (0.43) HPGDSMN1; SMN2
SCHEMBL7857644 0.76 NPC1 (0.36) HPGDATF4KDM4ENFE2L2L3MBTL1
SCHEMBL321232 0.76 HPGD (0.40) HPGDSMN1; SMN2NFE2L2
SCHEMBL7857637 0.74 SMN1; SMN2 (0.42) HPGDKDM4ECYP1A2CYP2C19SMN1; SMN2
SCHEMBL21281 0.74 PARP10 (0.44) HPGDSMN1; SMN2ALDH1A1
SCHEMBL18125568 0.74 HPGD (0.45) HPGDATF4KDM4ECYP1A2CYP2D6
SCHEMBL18123508 0.74 HRH3 (0.43) HPGDCYP1A2CYP2D6CYP2C19SMN1; SMN2
SCHEMBL3989257 0.73 PARP15 (0.53) HPGD

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927555-B1 Use of cyclooxygenase-2 inhibitors for the treatment and prevention of tumours, tumour-related disorders and cachexia DAIICHI SANKYO CO LTD (JP) 2011-10-05 EP disclosed
US-7745481-B2 Methods and compositions for the treatment and prevention of tumors, tumor-related disorders and cachexia DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-06-29 US disclosed
EP-0799823-B1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses DAIICHI SANKYO CO LTD (JP) 2007-10-31 EP disclosed
US-RE39420-E1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO COMPANY, LIMITED (JP) 2006-12-05 US disclosed
US-6887893-B1 Methods and compositions for treatment and prevention of tumors, tumor-related disorders and cachexia SANKYO COMPANY, LIMITED (JP) 2005-05-03 US disclosed
US-20050014814-A1 Methods and compositions for the treatment and prevention of tumors, tumor-related disorders and cachexia SANKYO COMPANY, LIMITED (JP) 2005-01-20 US disclosed
US-20050004109-A1 Methods and compositions for the treatment and prevention of tumors, tumor-related disorders and cachexia SANKYO COMPANY, LIMITED 2005-01-06 US disclosed
EP-0927555-A1 Use of cyclooxygenase-2 inhibitors for the treatment and prevention of tumors, tumor-related disorders and cachexia Sankyo Company Limited (JP) 1999-07-07 EP disclosed
US-5908858-A OSTEOPOROSIS; LEUKOTRIENE INHIBITOR SANKYO COMPANY, LIMITED (JP) 1999-06-01 US disclosed
EP-0799823-A1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1997-10-08 EP 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 (2 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-20050014814-A1 Methods and compositions for the treatment and prevention of tumors, tumor-related disorders and cachexia CPT1B, PYGM, PTGES2 HPGD 29/4885ATF4 1479/4885KDM4E 3798/4885
US-20050004109-A1 Methods and compositions for the treatment and prevention of tumors, tumor-related disorders and cachexia CPT1B, PYGM, PTGES2 HPGD 29/4885ATF4 1479/4885KDM4E 3798/4885

“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.