SCHEMBL2465658

SCHEMBL2465658

Cc1ccc(-c2c(C)ccn2-c2ccc(S(N)(=O)=O)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 12/20 0.60
PTGS1 P23219 6/20 0.60
CA1 P00915 9/20 0.53
CA2 P00918 9/20 0.53
CA9 Q16790 9/20 0.53
CA12 O43570 4/20 0.53
CA5A P35218 2/20 0.53
CA5B Q9Y2D0 2/20 0.53
CA3 P07451 1/20 0.53
CA6 P23280 1/20 0.53
CA7 P43166 1/20 0.53
CA4 P22748 5/20 0.50

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
SCHEMBL5333903 0.89 PTGS2 (0.60) PTGS2PTGS1CA1CA2CA9
SCHEMBL5312580 0.87 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL5337610 0.86 PTGS2 (0.47) PTGS2PTGS1CA1CA2CA9
SCHEMBL27448843 0.86 CA2 (0.53) PTGS2PTGS1CA1CA2CA9
SCHEMBL5309164 0.86 CA1 (0.55) PTGS2PTGS1CA1CA2CA9
SCHEMBL3690374 0.86 PTGS2 (0.47) PTGS2PTGS1CA1CA2CA9
SCHEMBL17917308 0.77 PTGS2 (0.54) PTGS2PTGS1CA1CA2CA9
SCHEMBL3690377 0.77 PTGS2 (0.41) PTGS2PTGS1CA1CA2CA9
SCHEMBL5337615 0.77 PTGS2 (0.40) PTGS2PTGS1CA1CA2CA9
SCHEMBL5315090 0.77 PTGS2 (0.74) PTGS2PTGS1CA1CA2CA9

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 19 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 claimed
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 claimed
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 claimed
JP-11180871-A None JP disclosed
JP-9323971-A None JP disclosed
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
CN-1151126-C 1, 2-diphenylpyrrole derivatives, their preparation and their therapeutic uses ������������ʽ���� 2004-05-26 CN 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
JP-H11180871-A MEDICINE CONTAINING 1,2-DIPHENYLPYRROLE DERIVATIVE SANKYO CO LTD 1999-07-06 JP disclosed
US-5908858-A OSTEOPOROSIS; LEUKOTRIENE INHIBITOR SANKYO COMPANY, LIMITED (JP) 1999-06-01 US disclosed
CN-1168372-A 1, 2-diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO CO (JP) 1997-12-24 CN disclosed
JP-H09323971-A 1,2-DIPHENYLPYRROLE DERIVATIVE AND MEDICINAL COMPOSITION SANKYO CO LTD 1997-12-16 JP 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 PTGS2 4/4885PTGS1 6/4885CA1 981/4885
US-20050004109-A1 Methods and compositions for the treatment and prevention of tumors, tumor-related disorders and cachexia CPT1B, PYGM, PTGES2 PTGS2 4/4885PTGS1 6/4885CA1 981/4885

“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.