SCHEMBL20174243

SCHEMBL20174243

c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4ccccc4-c4ccc5c(c4)C4(c6ccccc6-5)c5ccccc5-c5oc6ccccc6c54)n3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.33
ENPP3 O14638 1/20 0.32
ALOX5 P09917 1/20 0.32
KMT2A Q03164 5/20 0.32
MEN1 O00255 4/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 3/20 0.32
HPGD P15428 3/20 0.32
NTSR1 P30989 1/20 0.32
MAPK1 P28482 2/20 0.31
KDM4E B2RXH2 2/20 0.31
LMNA P02545 2/20 0.31
GLA P06280 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
DHODH Q02127 1/20 0.30
PLA2G2A P14555 1/20 0.30
PLA2G4A P47712 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
SCHEMBL22326538 1.00 PDK2 (0.33) PDK2ENPP3ALOX5KMT2AMEN1
SCHEMBL20174201 0.99 ALOX5 (0.32) PDK2ENPP3ALOX5KMT2AMEN1
SCHEMBL20174248 0.94 KMT2A (0.35) PDK2ENPP3ALOX5KMT2AMEN1
SCHEMBL20174205 0.93 ALOX5 (0.32) PDK2ALOX5KMT2AMEN1ALDH1A1
SCHEMBL20174225 0.92 KMT2A (0.37) PDK2ALOX5KMT2AMEN1ALDH1A1
SCHEMBL20174244 0.92 ALDH1A1 (0.33) ENPP3KMT2AALDH1A1MAPTHPGD
SCHEMBL20174218 0.92 KMT2A (0.35) PDK2KMT2AMEN1ALDH1A1MAPT
SCHEMBL20174222 0.91 ALDH1A1 (0.35) PDK2ENPP3KMT2AMEN1ALDH1A1
SCHEMBL20174710 0.91 PDK2 (0.34) PDK2ENPP3ALOX5KMT2AMEN1
SCHEMBL20174287 0.91 KMT2A (0.37) PDK2KMT2AMEN1ALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG PDK2 651/4885ENPP3 3214/4885ALOX5 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.