SCHEMBL914214

SCHEMBL914214

O=c1oc(-c2ccc(F)cc2)nc2ccsc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 1.00
▸ NPC1 O15118 7/20 0.74
▸ RAB9A P51151 7/20 0.74
▸ SMN1; SMN2 Q16637 2/20 0.74
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ HTT P42858 1/20 0.55
▸ ALDH1A1 P00352 2/20 0.47
▸ ELANE P08246 2/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.44
▸ RXFP1 Q9HBX9 2/20 0.44
▸ TP53 P04637 1/20 0.43
▸ ATM Q13315 2/20 0.41
▸ CTDSP1 Q9GZU7 1/20 0.41
▸ NOTUM Q6P988 1/20 0.41
▸ USP1 O94782 1/20 0.40
▸ USP19 O94966 1/20 0.40
▸ UCHL3 P15374 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.39
▸ MAOB P27338 1/20 0.38

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
SCHEMBL913579 0.84 MAPT (1.00) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL6171184 0.81 RAB9A (0.72) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4395617 0.76 MAPT (0.61) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL6032690 0.76 MAPT (0.61) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL25202713 0.75 MAPT (0.60) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL30500214 0.75 MAPT (0.60) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL916067 0.74 MAPT (0.65) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL913448 0.72 ELANE (0.78) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4187104 0.71 MAPT (0.55) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL914400 0.71 MAPT (1.00) MAPTNPC1RAB9ASMN1; SMN2MEN1

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 6 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
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

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 2054/4885NPC1 4151/4885RAB9A 3514/4885

“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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