SCHEMBL26166312

SCHEMBL26166312

c1ccc(-c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(ccc6ccccc65)c4)cc3)c3ccc(-c4ccc5c6ccc7ccccc7c6n(-c6ccccc6)c5c4)cc3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 2/20 0.33
HSD17B2 P37059 2/20 0.33
CA9 Q16790 2/20 0.32
PDPK1 O15530 8/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2B6 P20813 1/20 0.30
CYP2C19 P33261 1/20 0.30
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 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
SCHEMBL26166316 0.99 HSD17B1 (0.33) HSD17B1HSD17B2CA9PDPK1CA12
SCHEMBL26166187 0.97 CA9 (0.31) HSD17B1HSD17B2CA9CA12CA1
SCHEMBL26166190 0.96 CA12 (0.31) HSD17B1HSD17B2CA9CA12CA1
SCHEMBL26166282 0.96 CYP11B1 (0.32) HSD17B1HSD17B2CA9CA12CA1
SCHEMBL26166088 0.96 HSD17B1 (0.33) HSD17B1HSD17B2CA9CA12CA1
SCHEMBL26166342 0.96 CA12 (0.32) CA9CA12CA1CA2KDM4E
SCHEMBL26166307 0.96 PDPK1 (0.34) HSD17B1HSD17B2CA9PDPK1ESR1
SCHEMBL26166310 0.96 PDPK1 (0.34) HSD17B1HSD17B2CA9PDPK1ESR1
SCHEMBL26166236 0.95 CA12 (0.31) CA9CA12CA1CA2KDM4E
SCHEMBL26166091 0.95 HSD17B1 (0.32) HSD17B1HSD17B2CA9CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230172066-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-01 US disclosed
US-20230172066-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-01 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-20230172066-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME LAGE3, NR2E3, MAOA HSD17B1 4420/4885HSD17B2 3595/4885CA9 2944/4885

“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.