SCHEMBL914596

SCHEMBL914596

O=c1oc(-c2ccccc2Cl)nc2sc3c(c12)CCC3

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.77
ALDH1A1 P00352 7/20 0.77
HPGD P15428 7/20 0.77
KDM4E B2RXH2 5/20 0.77
CASP3 P42574 3/20 0.77
SENP7 Q9BQF6 2/20 0.77
SENP6 Q9GZR1 2/20 0.77
SMN1; SMN2 Q16637 9/20 0.70
KMT2A Q03164 6/20 0.70
MEN1 O00255 3/20 0.70
POLB P06746 3/20 0.70
L3MBTL1 Q9Y468 2/20 0.70
PLA2G1B P04054 1/20 0.70
BLM P54132 1/20 0.70
CASP6 P55212 1/20 0.70
CASP8 Q14790 1/20 0.70
CTDSP1 Q9GZU7 1/20 0.70
TDP1 Q9NUW8 1/20 0.70
ATG4B Q9Y4P1 1/20 0.70
RAB9A P51151 6/20 0.67

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
SCHEMBL914357 0.84 MAPT (0.74) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL914044 0.83 MAPT (0.73) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL29699807 0.83 MAPT (0.73) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL913600 0.83 SMN1; SMN2 (1.00) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL913664 0.82 MAPT (0.71) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL913332 0.81 MAPT (0.72) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL912737 0.80 SMN1; SMN2 (1.00) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL914110 0.77 SMN1; SMN2 (0.95) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL3368748 0.77 SMN1; SMN2 (1.00) MAPTALDH1A1HPGDKDM4ECASP3
SCHEMBL914037 0.76 SMN1; SMN2 (0.77) MAPTALDH1A1HPGDKDM4ECASP3

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-7872052-B2 Use of heterocyclic compounds as SCCE inhibitors AREXIS AB (SE) 2011-01-18 US claimed
EP-1631295-B1 USE OF CONDENSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN DISEASES AREXIS AB (SE) 2010-03-03 EP claimed
US-20060258651-A1 Use of heterocyclic compounds as scce inhibitors QUANTUM LTO HOLDINGS, LLC 2006-11-16 US claimed
EP-1631295-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER Arexis AB (SE) 2006-03-08 EP claimed
WO-2004108139-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER AREXIS AB (SE) 2004-12-16 WO claimed
US-7872052-B2 Use of heterocyclic compounds as SCCE inhibitors AREXIS AB (SE) 2011-01-18 US disclosed
EP-1631295-B1 USE OF CONDENSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN DISEASES AREXIS AB (SE) 2010-03-03 EP disclosed
US-20060258651-A1 Use of heterocyclic compounds as scce inhibitors QUANTUM LTO HOLDINGS, LLC 2006-11-16 US disclosed
EP-1631295-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER Arexis AB (SE) 2006-03-08 EP disclosed
WO-2004108139-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER AREXIS AB (SE) 2004-12-16 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 (1 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-20060258651-A1 Use of heterocyclic compounds as scce inhibitors RCE1, CTSE, SPINT2 MAPT 2054/4885ALDH1A1 584/4885HPGD 73/4885

“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.