SCHEMBL1945586

SCHEMBL1945586

CNC(=O)NC1CCCCC1.O=C(O)c1ccc2cc3cccccc-3c2c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 3/20 0.44
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GAA P10253 2/20 0.43
EPHX1 P07099 5/20 0.42
EPHX2 P34913 3/20 0.42
RAB9A P51151 2/20 0.42
PPARG P37231 1/20 0.41
HTT P42858 1/20 0.40
NPC1 O15118 1/20 0.40
CCKBR P32239 1/20 0.40

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
SCHEMBL1944616 0.81 GRIN2D (0.43) MEN1KMT2ASMN1; SMN2ALDH1A1GAA
SCHEMBL1948129 0.79 GRIN2D (0.44) MEN1KMT2ASMN1; SMN2ALDH1A1GAA
SCHEMBL1945585 0.77 RAB9A (0.54) MEN1KMT2ASMN1; SMN2LMNAALDH1A1
SCHEMBL1670668 0.76 MEN1 (0.61) MEN1KMT2ASMN1; SMN2LMNAALDH1A1
SCHEMBL22494493 0.69 NPC1 (0.59) MEN1KMT2ASMN1; SMN2LMNAALDH1A1
SCHEMBL8755930 0.68 PLA2G2D (0.53) MEN1KMT2ASMN1; SMN2ALDH1A1GAA
SCHEMBL19940662 0.68 EPHX1 (0.73) SMN1; SMN2ALDH1A1EPHX1EPHX2RAB9A
SCHEMBL966981 0.68 EPHX1 (0.73) SMN1; SMN2ALDH1A1EPHX1EPHX2RAB9A
SCHEMBL12812331 0.68 EPHX1 (0.73) SMN1; SMN2ALDH1A1EPHX1EPHX2RAB9A
SCHEMBL8394304 0.68 EPHX1 (0.73) SMN1; SMN2ALDH1A1EPHX1EPHX2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110130414-A1 NOVEL FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TORRENT PHARMACEUTICALS LIMITED (IN) 2011-06-02 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-20110130414-A1 NOVEL FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TPMT, ABCG2, TALDO1 MEN1 2163/4885KMT2A 4464/4885SMN1; SMN2 2617/4885

“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.