SCHEMBL10025480

SCHEMBL10025480

O=Cc1ccc(-c2nc3ccccc3s2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 10/20 1.00
▸ MAPT P10636 10/20 1.00
▸ KDM4E B2RXH2 9/20 1.00
▸ ALDH1A1 P00352 9/20 1.00
▸ MEN1 O00255 8/20 1.00
▸ KMT2A Q03164 8/20 1.00
▸ SMN1; SMN2 Q16637 4/20 1.00
▸ PKM P14618 1/20 1.00
▸ NPC1 O15118 9/20 0.59
▸ ATM Q13315 1/20 0.59
▸ NPSR1 Q6W5P4 3/20 0.56
▸ MAPK1 P28482 3/20 0.56
▸ POLB P06746 5/20 0.48
▸ HPGD P15428 4/20 0.48
▸ PSMD14 O00487 3/20 0.48
▸ PTPN22 Q9Y2R2 3/20 0.48
▸ MCL1 Q07820 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ DNMT1 P26358 1/20 0.48
▸ L3MBTL1 Q9Y468 5/20 0.47

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
SCHEMBL16160291 0.76 RAB9A (0.62) RAB9AMAPTKDM4EALDH1A1MEN1
SCHEMBL20718002 0.74 MAPT (0.58) RAB9AMAPTKDM4EALDH1A1MEN1
SCHEMBL31712298 0.74 RAB9A (0.58) RAB9AMAPTKDM4EALDH1A1MEN1
SCHEMBL12713530 0.74 RAB9A (0.58) RAB9AMAPTKDM4EALDH1A1MEN1
SCHEMBL827403 0.72 RAB9A (0.67) RAB9AMAPTKDM4EALDH1A1MEN1
SCHEMBL20718001 0.72 MAPT (0.55) RAB9AMAPTKDM4EALDH1A1MEN1
SCHEMBL5736417 0.71 KDM4E (0.55) RAB9AMAPTKDM4EALDH1A1MEN1
Hydrogen Sulfide SCHEMBL16859912 0.70 RAB9A (0.64) RAB9AMAPTKDM4EALDH1A1MEN1
Hydrogen Sulfide SCHEMBL28205214 0.70 RAB9A (0.64) RAB9AMAPTKDM4EALDH1A1MEN1
Methane SCHEMBL28056221 0.70 RAB9A (0.64) RAB9AMAPTKDM4EALDH1A1MEN1

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-8207173-B2 Benzimidazoles and analogs thereof as antivirals ISIS PHARMACEUTICALS, INC. (US) 2012-06-26 — — US disclosed
US-8207173-B2 Benzimidazoles and analogs thereof as antivirals ISIS PHARMACEUTICALS, INC. (US) 2012-06-26 — — US disclosed
US-20100130513-A1 BENZIMIDAZOLES AND ANALOGS THEREOF AS ANTIVIRALS ISIS PHARMACEUTICALS, INC. (US) 2010-05-27 — — US disclosed
US-20100130513-A1 BENZIMIDAZOLES AND ANALOGS THEREOF AS ANTIVIRALS ISIS PHARMACEUTICALS, INC. (US) 2010-05-27 — — US disclosed
US-7642265-B2 Benzimidazoles and analogs thereof as antivirals ISIS PHARMACEUTICALS, INC. (US) 2010-01-05 — — US disclosed
US-7642265-B2 Benzimidazoles and analogs thereof as antivirals ISIS PHARMACEUTICALS, INC. (US) 2010-01-05 — — 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-20100130513-A1 BENZIMIDAZOLES AND ANALOGS THEREOF AS ANTIVIRALS ZC3HAV1, NXF1, ZC3HAV1L RAB9A 2724/4885MAPT 4862/4885KDM4E 2466/4885

“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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