SCHEMBL2015666

SCHEMBL2015666

COC(=O)c1c(SCc2ccc(OC)cc2)cnc2ccc(OC)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.50
CYP1A2 P05177 3/20 0.46
MAPT P10636 7/20 0.45
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 4/20 0.45
HPGD P15428 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
LMNA P02545 2/20 0.45
TP53 P04637 3/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.44
NFKB1 P19838 1/20 0.44
RAB9A P51151 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP3A4 P08684 2/20 0.43

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
SCHEMBL2012625 0.76 PLA2G2A (0.50) PLA2G2ACYP1A2MAPTALDH1A1KDM4E
SCHEMBL2014731 0.75 PLA2G2A (0.49) PLA2G2ACYP1A2MAPTALDH1A1KDM4E
SCHEMBL17080124 0.74 KDM4E (0.52) CYP1A2ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL17080148 0.74 KDM4E (0.56) CYP1A2ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL2014297 0.72 L3MBTL1 (0.58) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL17080275 0.72 MEN1 (0.44) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL30786194 0.72 MEN1 (0.44) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL28326285 0.71 POLB (0.58) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL9869415 0.70 LMNA (0.53) CYP1A2MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL9869063 0.70 LMNA (0.53) CYP1A2MAPTALDH1A1KDM4EHPGD

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-9120822-B2 Tricyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2015-09-01 US 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
EP-2513115-B1 TRICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2013-10-09 EP 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 (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-20120245345-A1 TRICYCLIC ANTIBIOTICS CBR1, CBR3, C1S PLA2G2A 3163/4885CYP1A2 190/4885MAPT 4863/4885
US-20150072975-A1 TRICYCLIC ANTIBIOTICS TREH, MRPL21, SPOUT1 PLA2G2A 4774/4885CYP1A2 225/4885MAPT 3446/4885

“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.