SCHEMBL20174547

SCHEMBL20174547

c1ccc2c(c1)-c1ccc(-c3ccc4ccc5cccnc5c4n3)cc1C21c2ccccc2-c2sc3ccccc3c21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.34
KDM4E B2RXH2 3/20 0.34
MAPT P10636 3/20 0.34
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
OPRK1 P41145 2/20 0.34
KMT2A Q03164 2/20 0.34
ESR1 P03372 1/20 0.34
POLB P06746 1/20 0.34
AGTR1 P30556 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
PDK2 Q15119 1/20 0.33
ALOX15 P16050 2/20 0.32
TSHR P16473 2/20 0.32
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
GMNN O75496 1/20 0.32
TP53 P04637 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
SCHEMBL20174563 0.91 KDM4E (0.35) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL20174560 0.89 KDM4E (0.34) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL18590030 0.87 KDM4E (0.33) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL20174733 0.86 LMNA (0.37) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL20174522 0.85 MAPT (0.37) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL20174672 0.85 LMNA (0.34) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL20174554 0.85 LMNA (0.35) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL11962213 0.82 CCR1 (0.44) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL12708774 0.82 CCR1 (0.44) LMNAKDM4EMAPTMEN1ALDH1A1
SCHEMBL15944519 0.82 CCR1 (0.44) LMNAKDM4EMAPTMEN1ALDH1A1

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 LMNA 3057/4885KDM4E 3633/4885MAPT 811/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG LMNA 3057/4885KDM4E 3633/4885MAPT 811/4885

“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.