SCHEMBL2011734

SCHEMBL2011734

CCOC(=O)C1CSc2cnc3ccc(OC)cc3c2C1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
TP53 P04637 5/20 0.45
ALDH1A1 P00352 7/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
TAAR1 Q96RJ0 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 3/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
NMT1 P30419 1/20 0.41
HTT P42858 1/20 0.40
CLK1 P49759 1/20 0.40
GAA P10253 4/20 0.39
SLC2A1 P11166 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL2014624 0.69 MAPT (0.47) MAPTTP53ALDH1A1KMT2AMEN1
SCHEMBL17928609 0.68 CYP1A2 (0.40) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL12630209 0.67 KDM4E (0.41) MAPTALDH1A1NPSR1HPGDLMNA
SCHEMBL31603107 0.66 MAPT (0.63) MAPTTP53ALDH1A1KMT2AMEN1
SCHEMBL620359 0.66 MAPT (0.63) MAPTTP53ALDH1A1KMT2AMEN1
SCHEMBL2947439 0.65 MAPT (0.62) MAPTTP53ALDH1A1KMT2AMEN1
SCHEMBL438203 0.65 MAPT (0.62) MAPTTP53ALDH1A1KMT2AMEN1
SCHEMBL544894 0.65 MAPT (0.62) MAPTTP53ALDH1A1KMT2AMEN1
SCHEMBL14249026 0.65 NCF1 (0.36) MAPTALDH1A1HPGDLMNAKDM4E
SCHEMBL8055063 0.64 CA12 (0.43) MAPTTP53ALDH1A1KMT2AMEN1

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 MAPT 4863/4885TP53 4339/4885ALDH1A1 2967/4885
US-20150072975-A1 TRICYCLIC ANTIBIOTICS TREH, MRPL21, SPOUT1 MAPT 3446/4885TP53 4381/4885ALDH1A1 2268/4885

“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.