SCHEMBL1662638

SCHEMBL1662638

CCC(CC(=O)OC)c1c(Cl)ncnc1Cl

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 2/20 0.34
MAPT P10636 3/20 0.33
RAB9A P51151 2/20 0.33
TSHR P16473 1/20 0.32
ALDH1A1 P00352 4/20 0.32
KMT2A Q03164 2/20 0.32
HTT P42858 2/20 0.32
HSD17B10 Q99714 1/20 0.32
TNF P01375 2/20 0.32
HPGD P15428 1/20 0.32
KDM4E B2RXH2 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
EGFR P00533 1/20 0.31
NPC1 O15118 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL16457459 0.83 ALDH1A1 (0.32) MAPTRAB9AALDH1A1HTTSMN1; SMN2
SCHEMBL28796325 0.82 FFAR1 (0.38) LMNAMAPTTSHRALDH1A1KMT2A
SCHEMBL1662205 0.81 MAPT (0.37) L3MBTL1LMNAMAPTRAB9ATSHR
SCHEMBL15391066 0.81 MAPT (0.37) L3MBTL1LMNAMAPTRAB9ATSHR
SCHEMBL1662668 0.76 MAPK1 (0.33) L3MBTL1LMNAMAPTRAB9ATSHR
SCHEMBL11838560 0.72 LMNA (0.38) L3MBTL1LMNAMAPTTSHRALDH1A1
SCHEMBL16475601 0.72 PTGS2 (0.32) LMNAMAPTRAB9AALDH1A1KMT2A
SCHEMBL22307574 0.70 TSHR (0.41) L3MBTL1LMNAMAPTTSHRALDH1A1
SCHEMBL2062770 0.69 ALDH1A1 (0.42) L3MBTL1LMNAMAPTRAB9AALDH1A1
SCHEMBL11832514 0.69 L3MBTL1 (0.40) L3MBTL1LMNATSHRALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102574852-B AKT inhibitors LILLY CO ELI 2014-06-25 CN disclosed
EP-2491032-B1 AKT INHIBITORS LILLY CO ELI (US) 2014-04-16 EP disclosed
US-8436002-B2 AKT inhibitors ELI LILLY AND COMPANY (US) 2013-05-07 US disclosed
EP-2491032-A1 AKT INHIBITORS Eli Lilly and Company (US) 2012-08-29 EP disclosed
CN-102574852-A AKT inhibitors LILLY CO ELI 2012-07-11 CN disclosed
US-20120149684-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2012-06-14 US disclosed
WO-2011050016-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2011-04-28 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-20120149684-A1 AKT INHIBITORS AKT2, PIK3CA, AKT3 L3MBTL1 4845/4885LMNA 4267/4885MAPT 2496/4885

“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.