SCHEMBL20174558

SCHEMBL20174558

O=P(c1cccc2c1C1(c3ccccc3-2)c2ccccc2-c2sc3ccccc3c21)(c1cccc2ccccc12)c1cccc2ccccc12

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL20174679 0.83 KDM4E (0.31) KDM4ELMNAPOLB
SCHEMBL17533936 0.78 GPR3 (0.40) KDM4ELMNAPOLB
SCHEMBL20174305 0.74 KDM4E (0.32) KDM4ELMNAPOLB
SCHEMBL20174556 0.74 NPSR1 (0.30)
SCHEMBL20174732 0.73 MAPT (0.37) KDM4ELMNA
SCHEMBL20174562 0.73 S1PR4 (0.31)
SCHEMBL20174729 0.71 KDM4E (0.31) KDM4ELMNAPOLB
SCHEMBL17367237 0.71 GPR3 (0.36) KDM4ELMNA
SCHEMBL20174446 0.71 MAPT (0.36) KDM4ELMNA
SCHEMBL17716718 0.71 DHFR (0.30)

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 KDM4E 3633/4885LMNA 3057/4885POLB 4154/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG KDM4E 3633/4885LMNA 3057/4885POLB 4154/4885

“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.