SCHEMBL20174312

SCHEMBL20174312

c1ccc(-c2cc(-c3ccccc3-c3ccc4c(c3)-c3c(oc5ccccc35)C43c4ccccc4-c4ccccc43)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.32
KMT2A Q03164 2/20 0.32
ALOX5 P09917 2/20 0.32
PDK2 Q15119 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ACACA Q13085 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
SCHEMBL20174363 0.94 PDK2 (0.34) MAPK1KMT2AALOX5PDK2MEN1
SCHEMBL20174357 0.93 ENPP3 (0.33) MAPK1KMT2AALDH1A1MAPTHPGD
SCHEMBL20174391 0.88 CYP1A1 (0.37) MAPK1KMT2APDK2ALDH1A1MAPT
SCHEMBL20174355 0.88 KMT2A (0.33) MAPK1KMT2APDK2MEN1ALDH1A1
SCHEMBL20174347 0.87 MAPK1 (0.33) MAPK1KMT2AMEN1ALDH1A1MAPT
SCHEMBL20174322 0.87 PDK2 (0.39) MAPK1KMT2APDK2MEN1
SCHEMBL20174361 0.87 PDK2 (0.39) MAPK1KMT2APDK2MEN1
SCHEMBL20174398 0.87 PDK2 (0.39) MAPK1KMT2APDK2MEN1
SCHEMBL20174327 0.87 PDK2 (0.34) MAPK1KMT2AALOX5PDK2MEN1
SCHEMBL20174359 0.86 KMT2A (0.34) MAPK1KMT2APDK2MEN1ALDH1A1

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 MAPK1 3742/4885KMT2A 1480/4885ALOX5 2705/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG MAPK1 3742/4885KMT2A 1480/4885ALOX5 2705/4885

“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.