SCHEMBL15062387

SCHEMBL15062387

[c]1cc[c]c2c1Nc1ccccc1O2

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.52
DHODH Q02127 1/20 0.38
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
GAA P10253 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PARP1 P09874 1/20 0.33
MAPT P10636 4/20 0.32
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
LMNA P02545 1/20 0.31
HTR2B P41595 2/20 0.31
HTR7 P34969 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
SCHEMBL5161 0.79 ALOX5 (0.59) ALOX5DHODHMEN1KMT2AGAA
SCHEMBL25006 0.79 ALOX5 (0.59) ALOX5DHODHMEN1KMT2AGAA
SCHEMBL851887 0.73 ALOX5 (0.55) ALOX5DHODHMEN1KMT2AGAA
Phenoxazine SCHEMBL7862 0.70 ALOX5 (1.00) ALOX5DHODHMEN1KMT2AGAA
Phenoxazine SCHEMBL29355714 0.70 ALOX5 (1.00) ALOX5DHODHMEN1KMT2AGAA
Phenoxazine SCHEMBL28844098 0.70 ALOX5 (1.00) ALOX5DHODHMEN1KMT2AGAA
Phenoxazine SCHEMBL6310178 0.70 ALOX5 (1.00) ALOX5DHODHMEN1KMT2AGAA
Phenoxazine SCHEMBL25275195 0.68 ALOX5 (0.94) ALOX5DHODHMEN1KMT2AGAA
Phenoxazine SCHEMBL31267446 0.68 ALOX5 (0.94) ALOX5DHODHMEN1KMT2AGAA
Phenoxazine SCHEMBL5808288 0.68 ALOX5 (0.94) ALOX5DHODHMEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10472381-B2 Sialic acid derivatives REINHARD BROSSMER (DE) 2019-11-12 US disclosed
WO-2018172129-A1 SIALIC ACID DERIVATIVES WITH C-C TRIPLE BOND, AND PREPARATION THEREOF PRESCHER HORST (CH) 2018-09-27 WO disclosed
EP-3129390-A1 SIALIC ACID DERIVATIVES Brossmer, Reinhard (DE) 2017-02-15 EP disclosed
US-20160362436-A1 SIALIC ACID DERIVATIVES BROSSMER REINHARD (DE) 2016-12-15 US disclosed
EP-2797946-B1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2016-05-04 EP disclosed
US-9260467-B2 Sialic acid dimers BROSSMER REINHARD (DE) 2016-02-16 US disclosed
WO-2015128344-A1 SIALIC ACID DERIVATIVES BROSSMER REINHARD (DE) 2015-09-03 WO disclosed
EP-2910561-A1 Sialic acid derivatives Brossmer, Reinhard (DE) 2015-08-26 EP disclosed
US-20150005245-A1 Sialic Acid Dimers BROSSMER REINHARD (DE) 2015-01-01 US disclosed
EP-2797946-A1 SIALIC ACID DIMERS Brossmer, Reinhard (DE) 2014-11-05 EP disclosed
WO-2013097942-A1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2013-07-04 WO disclosed
EP-2610263-A1 Sialic acid dimers Brossmer, Reinhard (DE) 2013-07-03 EP 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 (3 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-10472381-B2 Sialic acid derivatives NEU1, NEU2, NEU3 ALOX5 995/4885DHODH 2072/4885MEN1 1137/4885
US-20160362436-A1 SIALIC ACID DERIVATIVES NEU1, NEU2, NEU3 ALOX5 997/4885DHODH 2076/4885MEN1 1135/4885
US-20150005245-A1 Sialic Acid Dimers SIGLEC9, SIGLEC7, NEU2 ALOX5 1537/4885DHODH 4157/4885MEN1 2389/4885

“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.