SCHEMBL25550890

SCHEMBL25550890

c1ccc(-c2cccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4c3oc3c(-c5ccccc5)cc(-c5ccccc5)cc34)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 2/20 0.33
HSD17B2 P37059 2/20 0.33
PRKDC P78527 1/20 0.32
CYP1A1 P04798 2/20 0.32
CYP1B1 Q16678 2/20 0.32
CYP1A2 P05177 1/20 0.32
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
GPR84 Q9NQS5 1/20 0.30
PTGES O14684 1/20 0.30
ALOX5 P09917 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
SCHEMBL25550889 0.97 HSD17B1 (0.34) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL25550878 0.97 HSD17B1 (0.34) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL25551001 0.97 HSD17B1 (0.34) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL25550999 0.93 PRKDC (0.36) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL25550873 0.93 CA12 (0.37) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL25550415 0.92 PRKDC (0.36) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL25550892 0.92 PRKDC (0.34) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL29303480 0.91 PRKDC (0.37) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL26165526 0.91 CYP1A1 (0.35) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1
SCHEMBL25550880 0.90 HSD17B1 (0.38) HSD17B1HSD17B2PRKDCCYP1A1CYP1B1

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 3607/4885PRKDC 3964/4885

“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.