SCHEMBL1185076

SCHEMBL1185076

CCOC(=O)CCC(=O)Nc1cc(C)ccc1C(=O)OC

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
KDM4E B2RXH2 5/20 0.55
HSD17B10 Q99714 4/20 0.55
HPGD P15428 3/20 0.55
MAPT P10636 5/20 0.52
NLRP3 Q96P20 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
LMNA P02545 3/20 0.47
GAA P10253 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47

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
SCHEMBL12217649 0.91 HSD17B10 (0.63) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL29783185 0.91 HSD17B10 (0.63) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL772143 0.87 MEN1 (0.56) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL1184638 0.87 KDM4E (0.53) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL2771144 0.86 KDM4E (0.57) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL1184790 0.84 KDM4E (0.66) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL29087668 0.80 HSD17B10 (0.67) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL1185533 0.80 MAPT (0.51) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL1185546 0.80 MEN1 (0.53) ALDH1A1KDM4EHPGDMAPTTDP1
SCHEMBL1186093 0.80 MAPT (0.51) ALDH1A1KDM4EHSD17B10HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1799684-B1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARM INC (US) 2014-12-03 EP disclosed
US-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-07-12 US disclosed
US-7935694-B2 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-05-03 US disclosed
US-20110039820-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-02-17 US disclosed
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-23 US disclosed
US-7459448-B2 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
EP-1799684-A2 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-27 EP disclosed
US-20060100194-A1 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. 2006-05-11 US disclosed
WO-2006041773-A2 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-04-20 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 (4 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-20060100194-A1 Lactam compounds useful as protein kinase inhibitors PRKCI, PIK3CA, AKT1 ALDH1A1 4635/4885KDM4E 1371/4885HSD17B10 2982/4885
US-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS PRKCI, PIK3CA, AKT1 ALDH1A1 4635/4885KDM4E 1371/4885HSD17B10 2982/4885
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors PRKCI, PIK3CA, AKT1 ALDH1A1 4635/4885KDM4E 1371/4885HSD17B10 2982/4885
US-20110039820-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS PRKCI, PIK3CA, AKT1 ALDH1A1 4635/4885KDM4E 1371/4885HSD17B10 2982/4885

“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.