SCHEMBL25550404

SCHEMBL25550404

c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(ccc6ccccc65)c4)cc3)c3cc(-c4ccccc4)cc4c3oc3c(-c5ccccc5)cccc34)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
CYP1A1 P04798 5/20 0.33
CYP1B1 Q16678 5/20 0.33
CYP1A2 P05177 5/20 0.33
PRKDC P78527 5/20 0.33
KDM4E B2RXH2 2/20 0.33
PDE5A O76074 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TP53 P04637 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 2/20 0.33
TSHR P16473 2/20 0.33
CYP2C19 P33261 2/20 0.33
HSD17B10 Q99714 2/20 0.33

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
SCHEMBL25550405 0.96 CA12 (0.35) CA12CA1CA2CA9CYP1A1
SCHEMBL25550425 0.94 CA12 (0.35) CA12CA1CA2CA9CYP1A1
SCHEMBL25550589 0.93 PRKDC (0.38) HSD17B1HSD17B2CA12CA1CA2
SCHEMBL25550413 0.93 PRKDC (0.38) HSD17B1HSD17B2CA12CA1CA2
SCHEMBL25550397 0.93 PRKDC (0.38) HSD17B1HSD17B2CA12CA1CA2
SCHEMBL25550407 0.93 CA12 (0.38) CA12CA1CA2CA9CYP1A1
SCHEMBL25550395 0.93 CA12 (0.38) HSD17B1HSD17B2CA12CA1CA2
SCHEMBL25550402 0.91 GPR84 (0.35) CYP1A2PRKDCKDM4EPDE5AALDH1A1
SCHEMBL25550399 0.91 CA12 (0.39) CA12CA1CA2CA9CYP1A2
SCHEMBL25550390 0.91 CA12 (0.39) CA12CA1CA2CA9CYP1A2

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-20230172059-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-01 US disclosed
US-20230172059-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-20230172059-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME ESR1, NFE2L2, LAGE3 HSD17B1 4251/4885HSD17B2 3607/4885CA12 1319/4885

“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.