SCHEMBL913788

SCHEMBL913788

CCc1cc2c(=O)oc(-c3ccc(Br)cc3)nc2s1

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.77
▸ KMT2A Q03164 3/20 0.77
▸ KDM4E B2RXH2 2/20 0.72
▸ F2 P00734 1/20 0.60
▸ NPC1 O15118 5/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ RAB9A P51151 3/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ TP53 P04637 1/20 0.47
▸ MAPT P10636 4/20 0.46
▸ TMIGD3 P0DMS9 3/20 0.43
▸ ADORA1 P30542 3/20 0.43
▸ HPGD P15428 1/20 0.43
▸ TARBP2 Q15633 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ AGTR1 P30556 1/20 0.39
▸ L3MBTL1 Q9Y468 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
SCHEMBL914095 0.87 MEN1 (1.00) MEN1KMT2AKDM4EF2NPC1
SCHEMBL913946 0.75 F2 (1.00) MEN1KMT2AKDM4EF2NPC1
SCHEMBL915807 0.74 MEN1 (1.00) MEN1KMT2AKDM4EF2NPC1
SCHEMBL11475733 0.74 MEN1 (0.58) MEN1KMT2AKDM4EF2NPC1
SCHEMBL6565665 0.68 TP53 (0.70) MEN1KMT2AKDM4ENPC1ALDH1A1
SCHEMBL10325841 0.67 NPC1 (1.00) MEN1KMT2AKDM4EF2NPC1
SCHEMBL11477834 0.67 F2 (0.52) MEN1KMT2AKDM4EF2ALDH1A1
SCHEMBL5381075 0.66 TP53 (0.65) MEN1KMT2AKDM4EF2NPC1
SCHEMBL6031759 0.66 MEN1 (0.65) MEN1KMT2AF2NPC1ALDH1A1
SCHEMBL6563910 0.65 HPN (0.56) MEN1KMT2AKDM4ENPC1ALDH1A1

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 MEN1 1609/4885KMT2A 2584/4885KDM4E 1362/4885

“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.

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