SCHEMBL13701431

SCHEMBL13701431

CCOc1cc(-c2nc(CCC(=O)c3ccccc3OF)co2)ccc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
POLB P06746 2/20 0.41
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
KDM4E B2RXH2 6/20 0.39
HSD17B10 Q99714 6/20 0.39
LMNA P02545 5/20 0.39
HPGD P15428 4/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
TSHR P16473 2/20 0.39
CTNNB1 P35222 2/20 0.39
WNT3A P56704 2/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
MAPK1 P28482 2/20 0.38
PKM P14618 1/20 0.38
CASP1 P29466 1/20 0.38
MEN1 O00255 2/20 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
SCHEMBL4280633 0.95 SMN1; SMN2 (0.45) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL4270743 0.95 SMN1; SMN2 (0.45) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL13701424 0.93 SMN1; SMN2 (0.45) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL4280889 0.92 S1PR1 (0.42) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL4285247 0.91 SMN1; SMN2 (0.40) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL4271351 0.91 S1PR1 (0.41) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL4275745 0.91 SMN1; SMN2 (0.41) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL20052038 0.91 SMN1; SMN2 (0.41) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL4279400 0.91 SMN1; SMN2 (0.41) SMN1; SMN2POLBS1PR1S1PR3KDM4E
SCHEMBL34465316 0.91 SMN1; SMN2 (0.41) SMN1; SMN2POLBS1PR1S1PR3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637559-B2 Oxazole compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-01-28 US disclosed
US-20090221586-A1 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-09-03 US 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-20090221586-A1 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION PDE3B, PDE4A, PDE3A SMN1; SMN2 3069/4885POLB 2310/4885S1PR1 964/4885

“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.