SCHEMBL3775347

SCHEMBL3775347

COC(=O)C1OC(C)(C)OC1CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
MAPT P10636 3/20 0.46
ITGA4 P13612 1/20 0.46
HSD17B10 Q99714 1/20 0.41
PLIN1 O60240 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
PLIN5 Q00G26 1/20 0.39
ABHD5 Q8WTS1 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.37
MEN1 O00255 1/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL3782873 0.86 ALDH1A1 (0.43) ALDH1A1HPGDLMNAKMT2APOLB
SCHEMBL3780544 0.79 LMNA (0.41) ALDH1A1MAPTITGA4HSD17B10PLIN1
SCHEMBL4142104 0.78 CA12 (0.40) ALDH1A1LMNAKMT2APOLBMEN1
SCHEMBL3776159 0.76 ALDH1A1 (0.40) ALDH1A1MAPTITGA4HSD17B10PLIN1
SCHEMBL16418145 0.75 CASP3 (0.42) ALDH1A1MAPTPLIN1HPGDALOX15
SCHEMBL17093339 0.75 ALDH1A1 (0.44) ALDH1A1MAPTITGA4ALOX15KMT2A
SCHEMBL20537413 0.75 ALDH1A1 (0.44) ALDH1A1MAPTITGA4ALOX15KMT2A
SCHEMBL28364920 0.75 ALDH1A1 (0.44) ALDH1A1MAPTITGA4ALOX15KMT2A
SCHEMBL15550283 0.75 ALDH1A1 (0.44) ALDH1A1MAPTITGA4ALOX15KMT2A
SCHEMBL29015087 0.75 ALDH1A1 (0.44) ALDH1A1MAPTITGA4ALOX15KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100324305-A1 PRODUCTION METHOD OF POLYCYCLIC LACTAMS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-23 US disclosed
US-20090118519-A1 Production Method of Polycyclic Lactams SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-07 US disclosed
EP-2014647-A1 PROCESS FOR PRODUCING POLYCYCLIC LACTAM Sumitomo Chemical Company, Limited (JP) 2009-01-14 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-20090118519-A1 Production Method of Polycyclic Lactams MRPL21, COASY, ASNS ALDH1A1 1979/4885MAPT 4812/4885ITGA4 1841/4885
US-20100324305-A1 PRODUCTION METHOD OF POLYCYCLIC LACTAMS COASY, MRPL21, ASNS ALDH1A1 1821/4885MAPT 4805/4885ITGA4 2277/4885

“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.