SCHEMBL20174660

SCHEMBL20174660

CC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4sc6ccccc6c4-5)nc(-c4ccc5ccccc5c4)n3)cc21

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.35
S1PR5 Q9H228 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
S1PR4 O95977 1/20 0.31

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
SCHEMBL20174644 0.94 S1PR5 (0.35) S1PR5L3MBTL1SLC6A2SLC6A4SLC6A3
SCHEMBL20174658 0.88 ALK (0.35) ALKL3MBTL1
SCHEMBL20174612 0.88 S1PR5 (0.36) S1PR5L3MBTL1S1PR4
SCHEMBL20174661 0.87 ALK (0.33) ALKL3MBTL1
SCHEMBL20174615 0.87 S1PR5 (0.35) S1PR5SLC6A2SLC6A4SLC6A3S1PR4
SCHEMBL22326567 0.87 CYP1A1 (0.41) S1PR5S1PR4
SCHEMBL20174620 0.87 CYP1A1 (0.41) S1PR5S1PR4
SCHEMBL20174736 0.86 S1PR5 (0.35) S1PR5L3MBTL1S1PR4
SCHEMBL20174533 0.85 S1PR5 (0.34) S1PR5SLC6A2SLC6A4SLC6A3S1PR4
SCHEMBL19008468 0.85 MEN1 (0.35) 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 ALK 2665/4885S1PR5 3034/4885L3MBTL1 2838/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG ALK 2665/4885S1PR5 3034/4885L3MBTL1 2838/4885

“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.