SCHEMBL20174535

SCHEMBL20174535

CC1(C)c2ccccc2-c2ccc(-c3nc(-c4cccc5c4-c4sc6ccccc6c4C54c5ccccc5-c5ccccc54)nc(-c4cccc5ccccc45)n3)cc21

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.31
HSP90AA1 P07900 1/20 0.30
S1PR1 P21453 1/20 0.30
S1PR3 Q99500 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL20174539 0.93 L3MBTL1 (0.31) L3MBTL1HSP90AA1
SCHEMBL20174533 0.85 S1PR5 (0.34) CNR1CNR2
SCHEMBL20174532 0.84 F9 (0.31) L3MBTL1HSP90AA1
SCHEMBL20174521 0.84 S1PR1 (0.35) L3MBTL1HSP90AA1S1PR1S1PR3CNR1
SCHEMBL20174661 0.83 ALK (0.33) L3MBTL1S1PR1S1PR3
SCHEMBL20174489 0.82 S1PR5 (0.37) L3MBTL1HSP90AA1CNR1CNR2
SCHEMBL15274130 0.82 ENPP3 (0.39) L3MBTL1S1PR1S1PR3
SCHEMBL12133799 0.82 ENPP3 (0.39) L3MBTL1S1PR1S1PR3
SCHEMBL17151892 0.81 ENPP3 (0.38) L3MBTL1S1PR1S1PR3
SCHEMBL20174447 0.81 MEN1 (0.33) L3MBTL1

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 L3MBTL1 2838/4885HSP90AA1 2901/4885S1PR1 2330/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG L3MBTL1 2838/4885HSP90AA1 2901/4885S1PR1 2330/4885

“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.