SCHEMBL987283

SCHEMBL987283

O=C1OCc2c1nc(Cl)nc2N1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 2/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.38
MAPT P10636 2/20 0.36
PTGS2 P35354 2/20 0.36
LMNA P02545 1/20 0.36
CASP1 P29466 1/20 0.35
MAT2A P31153 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
P2RX3 P56373 2/20 0.33
MAPK14 Q16539 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL2711236 0.78 MTOR (0.43)
SCHEMBL2711233 0.78 MTOR (0.43)
SCHEMBL2625357 0.73 HTR2C (0.38) ALDH1A1KDM4EHPGDSMN1; SMN2POLB
SCHEMBL983272 0.72 ACHE (0.31)
SCHEMBL7930954 0.70 SMN1; SMN2 (0.49) ALDH1A1KDM4EHSD17B10SMN1; SMN2POLB
SCHEMBL1833019 0.70 KDM4E (0.46) ALDH1A1KDM4EHPGDSMN1; SMN2POLB
SCHEMBL2710619 0.69 SMN1; SMN2 (0.40) ALDH1A1KDM4EHSD17B10HPGDSMN1; SMN2
SCHEMBL4973147 0.69 SMN1; SMN2 (0.48) ALDH1A1KDM4EHSD17B10SMN1; SMN2POLB
SCHEMBL15496464 0.69 SMN1; SMN2 (0.40) ALDH1A1KDM4EHSD17B10HPGDSMN1; SMN2
SCHEMBL13828583 0.68 SMN1; SMN2 (0.48) ALDH1A1HPGDSMN1; SMN2POLBMAPT

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
WO-2012099581-A1 DIHYDROFUROPYRIMIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-26 WO disclosed
US-20110021515-A1 DIHYROFUROPYRMINDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-27 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-20110021515-A1 DIHYROFUROPYRMINDINE COMPOUNDS MTOR, RICTOR, DEPTOR ALDH1A1 1928/4885KDM4E 1335/4885HSD17B10 2303/4885

“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.