SCHEMBL14979284

SCHEMBL14979284

CC(C)OC(=O)c1cc(Cl)ncc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.42
CA1 P00915 6/20 0.42
CA2 P00918 6/20 0.42
CA7 P43166 6/20 0.42
CA9 Q16790 6/20 0.42
CA14 Q9ULX7 6/20 0.42
ALDH1A1 P00352 3/20 0.42
POLB P06746 2/20 0.42
LMNA P02545 1/20 0.42
KDM4E B2RXH2 3/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38

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
SCHEMBL22834911 0.87 CA12 (0.42) CA12CA1CA2CA7CA9
SCHEMBL30217866 0.81 KDM4E (0.47) ALDH1A1POLBLMNAKDM4EMAPT
SCHEMBL236107 0.81 KDM4E (0.47) ALDH1A1POLBLMNAKDM4EMAPT
SCHEMBL16446984 0.81 CA12 (0.41) CA12CA1CA2CA7CA9
SCHEMBL3654468 0.80 KCNQ3 (0.43) CA12CA1CA2CA7CA9
SCHEMBL30567639 0.78 MAPK1 (0.40) ALDH1A1POLBKDM4ECYP1A2CYP2C9
SCHEMBL5762975 0.78 MAPK1 (0.40) ALDH1A1POLBKDM4ECYP1A2CYP2C9
SCHEMBL31368185 0.77 CYP4F2 (0.51) CA12CA1CA2CA7CA9
SCHEMBL6134191 0.77 CYP4F2 (0.51) CA12CA1CA2CA7CA9
SCHEMBL3653197 0.75 CA12 (0.41) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170152239-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS PFIZER INC. (US) 2017-06-01 US disclosed
US-20170152239-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS PFIZER INC. (US) 2017-06-01 US disclosed
US-20170152239-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS PFIZER INC. (US) 2017-06-01 US disclosed
US-20150239842-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS PFIZER INC. (US) 2015-08-27 US disclosed
US-20150239842-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS PFIZER INC. (US) 2015-08-27 US disclosed
US-20150239842-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS PFIZER INC. (US) 2015-08-27 US disclosed
EP-2900653-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS Pfizer Inc. (US) 2015-08-05 EP disclosed
WO-2013072825-A1 PHTALAZINONE DERIVATIVES AS MPEGS -1 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2013-05-23 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 (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-20150239842-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS HRH2, H1-0, H1-2 CA12 3128/4885CA1 3783/4885CA2 1211/4885
US-20170152239-A1 BENZAMIDE AND HETEROBENZAMIDE COMPOUNDS HRH2, HRH4, H1-0 CA12 3085/4885CA1 3963/4885CA2 1296/4885

“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.