SCHEMBL9890261

SCHEMBL9890261

c1cc(-c2cccc3c2oc2cc4c(cc23)oc2c(-n3c5ccccc5c5ccccc53)cccc24)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.40
GGPS1 O95749 1/20 0.38
PRKDC P78527 9/20 0.38
KDM4E B2RXH2 3/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
ALDH1A1 P00352 4/20 0.31
PIK3CD O00329 2/20 0.31
PIK3CA P42336 2/20 0.31
PIK3CB P42338 2/20 0.31
PIK3CG P48736 2/20 0.31
BRD4 O60885 2/20 0.31
BRD2 P25440 2/20 0.31
BRD3 Q15059 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
PDE2A O00408 1/20 0.31
PIK3C2A O00443 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
SCHEMBL1635446 0.94 ALOX5 (0.45) ALOX5GGPS1PRKDCKDM4EATM
SCHEMBL17228757 0.92 KDM4E (0.41) ALOX5GGPS1PRKDCKDM4EATM
SCHEMBL9890304 0.92 ALOX5 (0.44) ALOX5GGPS1PRKDCKDM4EPRMT5
SCHEMBL10038530 0.92 ALOX5 (0.43) ALOX5GGPS1PRKDCKDM4EATM
SCHEMBL9890267 0.90 ALOX5 (0.41) ALOX5GGPS1PRKDCKDM4EATM
SCHEMBL1637207 0.90 ALOX5 (0.44) ALOX5GGPS1PRKDCKDM4EATM
SCHEMBL9890264 0.90 KDM4E (0.41) ALOX5GGPS1PRKDCKDM4EATM
SCHEMBL9890269 0.89 PRKDC (0.41) ALOX5GGPS1PRKDCKDM4EPTGES2
SCHEMBL9890273 0.89 ALOX5 (0.39) ALOX5GGPS1PRKDCKDM4EATM
SCHEMBL9890303 0.89 ALOX5 (0.45) ALOX5GGPS1PRKDCKDM4EATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2013-01-24 US disclosed
US-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2013-01-24 US disclosed
US-8318323-B2 Polycyclic compounds and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2012-11-27 US disclosed
US-8318323-B2 Polycyclic compounds and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2012-11-27 US disclosed
US-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 US disclosed
US-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 US disclosed
US-20100012931-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2010-01-21 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-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME KCNC1, EED, BMI1 ALOX5 2756/4885GGPS1 1114/4885PRKDC 2162/4885
US-20100012931-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME KCNC1, EED, BMI1 ALOX5 2756/4885GGPS1 1114/4885PRKDC 2162/4885

“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.