SCHEMBL17858071

SCHEMBL17858071

c1ccc(P(c2ccccc2)c2cccc3c2oc2cccc(-n4c5ccccc5n5c6ccccc6nc45)c23)cc1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 2/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CSNK2B P67870 1/20 0.30
CSNK2A1 P68400 1/20 0.30
PIM3 Q86V86 1/20 0.30
CAMKK1 Q8N5S9 1/20 0.30
DYRK2 Q92630 1/20 0.30
CAMKK2 Q96RR4 1/20 0.30
MKNK1 Q9BUB5 1/20 0.30
PIM2 Q9P1W9 1/20 0.30

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
SCHEMBL17850763 0.87 NPC1 (0.36) NPC1RAB9AKDM4ELMNATP53
SCHEMBL17850787 0.84 NPC1 (0.34) NPC1RAB9AKDM4ELMNATP53
SCHEMBL17850777 0.84 NPC1 (0.34) NPC1RAB9AKDM4ELMNATP53
SCHEMBL17850700 0.83 TSHR (0.39) NPC1RAB9AKDM4ELMNATP53
SCHEMBL17850790 0.83 GABRP (0.40) NPC1RAB9AKDM4ELMNATP53
SCHEMBL17850749 0.82 NPC1 (0.37) NPC1RAB9AKDM4ELMNATP53
SCHEMBL17850764 0.81 NPC1 (0.33) NPC1RAB9AKDM4ELMNATP53
SCHEMBL17850791 0.80 NPC1 (0.33) NPC1RAB9AKDM4ELMNATP53
SCHEMBL19726302 0.80 KDM4E (0.34) NPC1RAB9AKDM4ELMNATP53
SCHEMBL17850785 0.79 NPC1 (0.31) NPC1RAB9A

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-20170362241-A1 1-FUNCTIONALIZED DIBENZOFURANS AND DIBENZOTHIOPHENES FOR ORGANIC LIGHT EMITTING DIODES (OLEDS) IDEMITSU KOSAN CO., LTD. (JP) 2017-12-21 US disclosed
US-20170362241-A1 1-FUNCTIONALIZED DIBENZOFURANS AND DIBENZOTHIOPHENES FOR ORGANIC LIGHT EMITTING DIODES (OLEDS) IDEMITSU KOSAN CO., LTD. (JP) 2017-12-21 US disclosed
WO-2016097983-A1 1-FUNCTIONALIZED DIBENZOFURANS AND DIBENZOTHIOPHENES FOR ORGANIC LIGHT EMITTING DIODES (OLEDS) IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 WO 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-20170362241-A1 1-FUNCTIONALIZED DIBENZOFURANS AND DIBENZOTHIOPHENES FOR ORGANIC LIGHT EMITTING DIODES (OLEDS) OCIAD1, OCIAD2, DDT NPC1 817/4885RAB9A 2312/4885KDM4E 4056/4885

“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.