SCHEMBL2014648

SCHEMBL2014648

COc1ccc2ncc(O)c(C=O)c2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 5/20 0.56
TRIM24 O15164 1/20 0.55
TYR P14679 1/20 0.55
TRIM33 Q9UPN9 1/20 0.55
KDM4E B2RXH2 3/20 0.48
MAPK1 P28482 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
LMNA P02545 1/20 0.47
ALDH1A1 P00352 5/20 0.45
HPGD P15428 2/20 0.43
F2 P00734 1/20 0.43
GLA P06280 1/20 0.43
GABRA1 P14867 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL591501 0.82 ALDH1A1 (0.45) ERN1TRIM24TYRTRIM33KDM4E
SCHEMBL2014269 0.82 ALDH1A1 (0.45) ERN1TRIM24TYRTRIM33KDM4E
SCHEMBL2942171 0.82 ALDH1A1 (0.45) ERN1TRIM24TYRTRIM33KDM4E
SCHEMBL13652181 0.77 KDM4E (0.49) TRIM24TYRTRIM33KDM4EMAPK1
SCHEMBL2011169 0.77 LMNA (0.57) TRIM24TYRTRIM33KDM4EMAPK1
SCHEMBL2012625 0.75 PLA2G2A (0.50) TRIM24TYRTRIM33KDM4EMAPK1
SCHEMBL5229299 0.75 ERN1 (0.57) ERN1TRIM24TYRTRIM33MAPK1
SCHEMBL13652214 0.75 ALDH1A1 (0.50) ERN1TRIM24TYRTRIM33KDM4E
SCHEMBL2010360 0.75 LMNA (0.44) TRIM24TYRTRIM33KDM4EMAPK1
SCHEMBL30345210 0.75 ALDH1A1 (0.50) ERN1TRIM24TYRTRIM33KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2721034-B1 N-HETEROTRICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2016-07-20 EP disclosed
CN-103635474-B Tricyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2016-04-27 CN disclosed
US-9321788-B2 Tricyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2016-04-26 US disclosed
US-9321788-B2 Tricyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2016-04-26 US disclosed
US-9120822-B2 Tricyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2015-09-01 US disclosed
CN-102666548-B Tricyclic antibiotics BASILEA PHARMACEUTICA AG 2015-07-15 CN disclosed
US-20150072975-A1 TRICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG 2015-03-12 US disclosed
US-8927541-B2 Tricyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2015-01-06 US disclosed
US-20140235855-A1 Tricyclic Antibiotics BASILEA PHARMACEUTICA AG (CH) 2014-08-21 US disclosed
US-20140235855-A1 Tricyclic Antibiotics BASILEA PHARMACEUTICA AG (CH) 2014-08-21 US disclosed
EP-2721034-A1 TRICYCLIC ANTIBIOTICS Basilea Pharmaceutica AG (CH) 2014-04-23 EP disclosed
EP-2513115-B1 TRICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2013-10-09 EP disclosed
WO-2012171860-A1 TRICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2012-12-20 WO disclosed
EP-2513115-A1 TRICYCLIC ANTIBIOTICS Basilea Pharmaceutica AG (CH) 2012-10-24 EP disclosed
US-20120245345-A1 TRICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2012-09-27 US disclosed
WO-2011073378-A1 TRICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2011-06-23 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 (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-20120245345-A1 TRICYCLIC ANTIBIOTICS CBR1, CBR3, C1S ERN1 687/4885TRIM24 4263/4885TYR 2907/4885
US-20140235855-A1 Tricyclic Antibiotics CBR1, CYP2S1, C1S ERN1 389/4885TRIM24 4282/4885TYR 2114/4885
US-20150072975-A1 TRICYCLIC ANTIBIOTICS TREH, MRPL21, SPOUT1 ERN1 1370/4885TRIM24 2498/4885TYR 667/4885

“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.