SCHEMBL9917129

SCHEMBL9917129

Cc1ccc2c3ccc(-c4cccc5c4oc4ccccc45)cc3c3ccccc3c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.59
PRKDC P78527 4/20 0.46
MAOB P27338 3/20 0.44
GGPS1 O95749 1/20 0.44
PTGES2 Q9H7Z7 1/20 0.41
TNKS O95271 1/20 0.41
PARP1 P09874 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
PARP2 Q9UGN5 1/20 0.41
TP53 P04637 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP3A4 P08684 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAOA P21397 1/20 0.37
ATM Q13315 1/20 0.37
LMNA P02545 1/20 0.37
RET P07949 1/20 0.37

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
SCHEMBL17716010 0.91 ALOX5 (0.59) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL15785776 0.91 ALOX5 (0.59) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL12175683 0.91 ALOX5 (0.69) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL14924577 0.91 ALOX5 (0.69) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL30022593 0.91 ALOX5 (0.69) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL16302998 0.91 ALOX5 (0.69) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL16133291 0.90 ALOX5 (0.68) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL20698073 0.90 ALOX5 (0.68) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL16133304 0.90 ALOX5 (0.68) ALOX5PRKDCMAOBGGPS1PTGES2
SCHEMBL12850770 0.87 ALOX5 (0.57) ALOX5PRKDCMAOBGGPS1PTGES2

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-10355218-B2 Aromatic amine derivatives and organic electroluminescent elements using same IDEMITSU KOSAN CO., LTD. (JP) 2019-07-16 US disclosed
US-20170162790-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2017-06-08 US disclosed
US-9614160-B2 Aromatic amine derivatives and organic electroluminescent elements using same IDEMITSU KOSAN CO., LTD. (JP) 2017-04-04 US disclosed
US-20160064669-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-03-03 US disclosed
US-9260390-B2 Aromatic amine derivatives and organic electroluminescent elements using same IDEMITSU KOSAN CO., LTD. (JP) 2016-02-16 US disclosed
US-20120146014-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-06-14 US disclosed
WO-2011139129-A2 TRIPHENYLENE-BASED COMPOUND COMPRISING AN AROMATIC AMINE AND AN ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING THE SAME 주식회사 두산 (KR) 2011-11-10 WO 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 (4 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-20170162790-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME RER1, NR4A1, REL ALOX5 1894/4885PRKDC 4598/4885MAOB 331/4885
US-10355218-B2 Aromatic amine derivatives and organic electroluminescent elements using same RER1, NR4A1, REL ALOX5 1881/4885PRKDC 4590/4885MAOB 333/4885
US-20120146014-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 ALOX5 1407/4885PRKDC 4060/4885MAOB 208/4885
US-20160064669-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 ALOX5 1407/4885PRKDC 4060/4885MAOB 208/4885

“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.