SCHEMBL21497923

SCHEMBL21497923

c1ccc2c(c1)cc(-c1cc(-c3cc4ccccc4c4ccccc34)ncn1)c1ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.46
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 5/20 0.44
HIF1A Q16665 2/20 0.44
TSHR P16473 2/20 0.44
HPGD P15428 2/20 0.44
MAPK1 P28482 2/20 0.44
CASP1 P29466 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TRPM4 Q8TD43 1/20 0.43
NISCH Q9Y2I1 1/20 0.43
CYP1B1 Q16678 1/20 0.43
HPRT1 P00492 2/20 0.41
CYP2A6 P11509 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 2/20 0.38
GPR3 P46089 1/20 0.38
MAPT P10636 3/20 0.37
MEN1 O00255 1/20 0.37
MPI P34949 1/20 0.37

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
SCHEMBL14718746 0.82 CYP11B1 (0.50) CYP11B1ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL29362973 0.82 CYP11B1 (0.50) CYP11B1ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL2128249 0.81 MEN1 (0.49) ALDH1A1HSD17B10HPGDMAPK1NISCH
SCHEMBL29406150 0.81 MEN1 (0.49) ALDH1A1HSD17B10HPGDMAPK1NISCH
SCHEMBL14725247 0.81 CYP11B1 (0.49) CYP11B1ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL14725245 0.81 CYP11B1 (0.49) CYP11B1ALDH1A1TSHRHPGDL3MBTL1
SCHEMBL29751148 0.80 CYP11B1 (0.35) CYP11B1HPGDL3MBTL1NISCHHPRT1
SCHEMBL27926692 0.79 MEN1 (0.47) ALDH1A1HSD17B10HPGDMAPK1NISCH
SCHEMBL14725233 0.79 MEN1 (0.47) ALDH1A1HSD17B10HPGDMAPK1NISCH
SCHEMBL14725274 0.78 CYP11B1 (0.46) CYP11B1ALDH1A1HSD17B10HIF1ATSHR

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-10454043-B2 Heterocyclic compound and organic light-emitting element using same HEESUNG MATERIAL LTD. (KR) 2019-10-22 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-10454043-B2 Heterocyclic compound and organic light-emitting element using same CRY1, CRY2, PER2 CYP11B1 1115/4885ALDH1A1 953/4885HSD17B10 2409/4885

“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.