SCHEMBL19006265

SCHEMBL19006265

CCOC(=O)c1ccc(-c2coc(CC)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
S1PR1 P21453 6/20 0.49
MAPT P10636 4/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
ESR1 P03372 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
ESR2 Q92731 1/20 0.47
CA14 Q9ULX7 1/20 0.47
CYP1A2 P05177 2/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAOA P21397 1/20 0.46
RAB9A P51151 4/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL24595884 0.84 NPC1 (0.55) NPC1MEN1KMT2AMAPTCA12
SCHEMBL18999249 0.81 NPC1 (0.55) NPC1MEN1KMT2AMAPTCA12
SCHEMBL19006266 0.81 NPC1 (0.55) NPC1MEN1KMT2AMAPTCA12
SCHEMBL2949886 0.80 KMT2A (0.54) NPC1MEN1KMT2AS1PR1MAPT
SCHEMBL24595883 0.80 NPC1 (0.54) NPC1MEN1KMT2AMAPTCA12
SCHEMBL7217126 0.80 ENPP3 (0.54) NPC1MEN1KMT2AMAPTLMNA
SCHEMBL7215537 0.79 TARBP2 (0.55) NPC1MEN1KMT2AS1PR1MAPT
SCHEMBL7221048 0.76 MAPT (0.51) NPC1MEN1KMT2AS1PR1MAPT
SCHEMBL9198367 0.76 S1PR1 (0.55) S1PR1MAPTESR1ESR2ALDH1A1
SCHEMBL15711821 0.75 ENPP3 (0.46) NPC1MEN1KMT2AS1PR1MAPT

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-20170174693-A1 SOLUBLE GUANYLATE CYCLASE STIMULATORS MERCK SHARP & DOHME LLC 2017-06-22 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-20170174693-A1 SOLUBLE GUANYLATE CYCLASE STIMULATORS GUCY1A1, GUCY1A2, PDE2A NPC1 2748/4885MEN1 1128/4885KMT2A 4661/4885

“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.