SCHEMBL20174653

SCHEMBL20174653

c1ccc(-c2cccc(-c3cc(-c4ccccc4-c4cccc5c4-c4ccccc4C54c5ccccc5-c5c4sc4ccccc54)nc(-c4ccccc4)n3)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
KMT2A Q03164 2/20 0.32
GLA P06280 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
SCHEMBL20174597 0.91 MEN1 (0.37) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL20174650 0.90 MEN1 (0.38) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL20174607 0.90 MEN1 (0.38) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL20174652 0.89 MEN1 (0.34) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL20174569 0.89 MEN1 (0.38) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL20174651 0.88 MEN1 (0.39) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL20174655 0.88 MEN1 (0.37) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL20174643 0.88 MEN1 (0.33) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL20174635 0.88 SLC9A1 (0.32)
SCHEMBL20174531 0.87 KDM4E (0.31) KDM4EMEN1ALDH1A1LMNAMAPT

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 3633/4885MEN1 611/4885ALDH1A1 33/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG KDM4E 3633/4885MEN1 611/4885ALDH1A1 33/4885

“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.