SCHEMBL20173111

SCHEMBL20173111

c1ccc2c(c1)-c1cc(-c3cccc4c3oc3ccccc34)ccc1C21c2ccccc2-c2cc3c4ccccc4c4ccccc4c3cc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.53
GGPS1 O95749 1/20 0.43
PRKDC P78527 5/20 0.40
PTGES2 Q9H7Z7 1/20 0.38
ATM Q13315 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
AHR P35869 2/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL17929439 1.00 ALOX5 (0.53) ALOX5GGPS1PRKDCPTGES2ATM
SCHEMBL17929455 0.96 ALOX5 (0.50) ALOX5GGPS1PRKDCPTGES2ATM
SCHEMBL20173010 0.95 ALOX5 (0.53) ALOX5GGPS1PRKDCPTGES2ATM
SCHEMBL21688394 0.94 ALOX5 (0.59) ALOX5GGPS1PRKDCPTGES2ATM
SCHEMBL12996570 0.88 ALOX5 (0.59) ALOX5GGPS1PRKDCPTGES2ATM
SCHEMBL17614164 0.88 ALOX5 (0.59) ALOX5GGPS1PRKDCPTGES2ATM
SCHEMBL22617636 0.86 ALOX5 (0.52) ALOX5GGPS1PRKDCPTGES2ATM
SCHEMBL22617593 0.86 ALOX5 (0.52) ALOX5GGPS1PRKDCPTGES2ATM
SCHEMBL22617715 0.86 ALOX5 (0.45) ALOX5GGPS1PRKDCPTGES2
SCHEMBL10057954 0.86 ALOX5 (0.54) ALOX5GGPS1PRKDCPTGES2ATM

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-10651411-B2 Compound and organic light emitting device containing same LG CHEM, LTD. (KR) 2020-05-12 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING 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-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME CRY1, CRY2, OR10J3 ALOX5 695/4885GGPS1 84/4885PRKDC 3702/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 ALOX5 695/4885GGPS1 84/4885PRKDC 3702/4885

“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.