SCHEMBL23448776

SCHEMBL23448776

c1cc(-c2cc3ccccc3c3ccccc23)cc(N(c2ccc(-c3ccc4ccccc4c3)cc2)c2ccc(-c3cccc4sc5ccccc5c34)cc2)c1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 8/20 0.35
S1PR4 O95977 6/20 0.35
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP1 P29466 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
CYP11B1 P15538 1/20 0.31
HSD17B1 P14061 1/20 0.31
HSD17B2 P37059 1/20 0.31
ALOX5 P09917 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL24839223 0.99 S1PR5 (0.35) S1PR5S1PR4ALDH1A1HPGDTSHR
SCHEMBL23448304 0.98 S1PR5 (0.34) S1PR5S1PR4ALDH1A1HPGDTSHR
SCHEMBL25534854 0.95 S1PR5 (0.38) S1PR5S1PR4CYP11B1HSD17B1HSD17B2
SCHEMBL23448786 0.95 S1PR5 (0.35) S1PR5S1PR4ALDH1A1HPGDTSHR
SCHEMBL23224670 0.94 F9 (0.34) S1PR5S1PR4ALDH1A1HPGDTSHR
SCHEMBL22671298 0.94 ALDH1A1 (0.34) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL25534903 0.94 S1PR5 (0.38) S1PR5S1PR4CYP11B1HSD17B1HSD17B2
SCHEMBL25535834 0.94 S1PR5 (0.38) S1PR5S1PR4GPR84CYP11B1HSD17B1
SCHEMBL25137840 0.94 S1PR5 (0.36) S1PR5S1PR4CYP11B1HSD17B1HSD17B2
SCHEMBL23225316 0.93 S1PR5 (0.38) S1PR5S1PR4HSD17B1HSD17B2CA12

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-20230002420-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2023-01-05 US disclosed
WO-2021107737-A1 ORGANIC LIGHT-EMITTING ELEMENT 주식회사 엘지화학 2021-06-03 WO 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-20230002420-A1 ORGANIC LIGHT-EMITTING ELEMENT CYBA, CRY1, CYP1A1 S1PR5 4708/4885S1PR4 4707/4885ALDH1A1 94/4885

“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.