SCHEMBL3663956

SCHEMBL3663956

CCOC(=O)Cc1csc(N)c1C(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.57
MAPK1 P28482 3/20 0.57
POLB P06746 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MAPT P10636 6/20 0.49
HPGD P15428 3/20 0.49
GAA P10253 2/20 0.49
RECQL P46063 1/20 0.49
HSD17B10 Q99714 6/20 0.48
TSHR P16473 1/20 0.48
KDM4E B2RXH2 1/20 0.47
PRKCZ Q05513 7/20 0.46
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
LMNA P02545 1/20 0.46
ALOX15 P16050 3/20 0.44
MPI P34949 1/20 0.44
USP2 O75604 1/20 0.44
KEAP1 Q14145 1/20 0.44
TDP1 Q9NUW8 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
SCHEMBL4933891 0.91 ALDH1A1 (0.68) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL8188113 0.85 ALDH1A1 (0.52) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL10711429 0.83 ALDH1A1 (0.55) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL16663489 0.79 ALDH1A1 (0.68) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL10532585 0.79 ALDH1A1 (0.75) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL1522436 0.79 ALDH1A1 (0.56) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL31464158 0.76 ALDH1A1 (0.48) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL31464156 0.76 ALDH1A1 (0.48) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL13369154 0.75 ALDH1A1 (0.69) ALDH1A1MAPK1POLBSMN1; SMN2MAPT
SCHEMBL14697944 0.75 ALDH1A1 (0.74) ALDH1A1MAPK1POLBSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 US disclosed
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 US disclosed
EP-2139887-A2 METALLOPROTEASE INHIBITORS CONTAINING A HETEROCYCLIC MOIETY Alantos Pharmaceuticals Holding, Inc. (US) 2010-01-06 EP disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 US disclosed
WO-2008109180-A2 METALLOPROTEASE INHIBITORS CONTAINING A HETEROCYCLIC MOIETY ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-09-12 WO disclosed
WO-2008109180-A2 METALLOPROTEASE INHIBITORS CONTAINING A HETEROCYCLIC MOIETY ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-09-12 WO disclosed
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 US disclosed
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 US disclosed
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 US 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-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety MMP12, MMP13, MMP25 ALDH1A1 714/4885MAPK1 1825/4885POLB 2906/4885
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 ALDH1A1 1871/4885MAPK1 2672/4885POLB 430/4885

“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.