SCHEMBL20174443

SCHEMBL20174443

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5sc6ccccc6c54)c3)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
SLC9A1 P19634 1/20 0.32
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
F9 P00740 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
ADORA2B P29275 1/20 0.30
L3MBTL1 Q9Y468 2/20 0.30
HSP90AA1 P07900 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
SCHEMBL20174478 0.98 ALOX5 (0.34) ALOX5SLC9A1ADORA2AADORA1L3MBTL1
SCHEMBL20174499 0.91 S1PR5 (0.36) ALOX5SLC9A1F9L3MBTL1
SCHEMBL22326564 0.89 MEN1 (0.36) ALOX5SLC9A1ADORA2AADORA1F9
SCHEMBL20174456 0.89 MEN1 (0.36) ALOX5SLC9A1ADORA2AADORA1F9
SCHEMBL20179291 0.89 MEN1 (0.34)
SCHEMBL20174460 0.88 L3MBTL1 (0.35) SLC9A1ADORA2AADORA1F9ADORA3
SCHEMBL20174485 0.88 MEN1 (0.36) ALOX5SLC9A1ADORA2AADORA1F9
SCHEMBL20174525 0.88 MEN1 (0.36) SLC9A1
SCHEMBL20174445 0.86 MEN1 (0.34) ALOX5SLC9A1ADORA2AADORA1F9
SCHEMBL22326533 0.86 MEN1 (0.34) ALOX5SLC9A1ADORA2AADORA1F9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10738034-B2 Spiro compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2020-08-11 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 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 (2 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-10738034-B2 Spiro compound and organic light-emitting device comprising same CRY1, NR2E3, ERG ALOX5 2705/4885SLC9A1 3444/4885ADORA2A 3056/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG ALOX5 2705/4885SLC9A1 3444/4885ADORA2A 3056/4885

“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.