SCHEMBL13620971

SCHEMBL13620971

CCC(C)c1cc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)c(C(C)CC)cc1-c1nc2ccccc2o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.48
ALDH1A1 P00352 5/20 0.48
HPGD P15428 4/20 0.48
USP2 O75604 3/20 0.48
MAPT P10636 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
TSHR P16473 1/20 0.41
P2RY6 Q15077 1/20 0.41
HSD17B10 Q99714 5/20 0.40
MAPK1 P28482 1/20 0.39
POLB P06746 2/20 0.39
TP53 P04637 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 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
SCHEMBL13620969 0.89 KDM4E (0.52) KDM4EALDH1A1HPGDUSP2MAPT
SCHEMBL13620966 0.79 KDM4E (0.52) KDM4EALDH1A1HPGDUSP2MAPT
SCHEMBL13621086 0.79 KDM4E (0.43) KDM4EALDH1A1HPGDUSP2MAPT
SCHEMBL13620970 0.79 KDM4E (0.49) KDM4EALDH1A1HPGDUSP2MAPT
SCHEMBL13621042 0.78 SMN1; SMN2 (0.45) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL13620962 0.78 ALDH1A1 (0.55) KDM4EALDH1A1HPGDUSP2MAPT
SCHEMBL13620958 0.78 ALDH1A1 (0.55) KDM4EALDH1A1HPGDUSP2MAPT
SCHEMBL13620965 0.77 KDM4E (0.59) KDM4EALDH1A1HPGDUSP2MAPT
SCHEMBL13620967 0.77 KDM4E (0.50) KDM4EALDH1A1HPGDUSP2MAPT
SCHEMBL13620973 0.77 ALDH1A1 (0.55) KDM4EALDH1A1HPGDUSP2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859108-B2 Benzoxazole derivative, and light-emitting element, light-emitting device, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-14 US disclosed
US-8859108-B2 Benzoxazole derivative, and light-emitting element, light-emitting device, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-14 US disclosed
US-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABARATORY CO., LTD. 2009-11-19 US disclosed
US-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABARATORY CO., LTD. 2009-11-19 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-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same CYP4X1, XDH, GABRA5 KDM4E 2877/4885ALDH1A1 169/4885HPGD 700/4885

“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.