SCHEMBL21473095

SCHEMBL21473095

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc5c6c4c4ccccc4c4ccc7c8ccccc8n5c7c46)c3)n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
CYP2C9 P11712 2/20 0.31
HSD17B10 Q99714 2/20 0.31
USP2 O75604 1/20 0.31
CYP2D6 P10635 1/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
KDM4E B2RXH2 2/20 0.30
NR1I3 Q14994 2/20 0.30
VDR P11473 1/20 0.30
CYP2B6 P20813 1/20 0.30
AHR P35869 1/20 0.30
TSHR P16473 1/20 0.30
ACP1 P24666 1/20 0.30
STAT6 P42226 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL21472952 0.89 KDM4E (0.32) KDM4E
SCHEMBL21472984 0.85 MEN1 (0.34) CYP1A2CYP3A4CYP2C9HSD17B10USP2
SCHEMBL21473026 0.85 TSPO (0.30)
SCHEMBL21473021 0.85 HSP90AA1 (0.33) HSD17B10KDM4ETSHR
SCHEMBL21472957 0.82 PSEN1 (0.32) HSD17B10KDM4ETSHR
SCHEMBL21472982 0.82 TSPO (0.34) KDM4E
SCHEMBL21472963 0.81 ACP1 (0.35) HSD17B10ALOX15KDM4ETSHRACP1
SCHEMBL24395067 0.80
SCHEMBL21472964 0.80 MEN1 (0.35) HSD17B10MAPK1KDM4ETSHRACP1
SCHEMBL21473023 0.80 MEN1 (0.33) HSD17B10ALOX15MAPK1KDM4ETSHR

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-20190315759-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2019-10-17 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-20190315759-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES OSBP, OSBP2, OSBPL3 CYP1A2 1794/4885CYP3A4 1446/4885CYP2C9 900/4885

“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.