SCHEMBL244775

SCHEMBL244775

NCc1nc2ccccc2s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UBE2T Q9NPD8 1/20 1.00
ASIC3 Q9UHC3 1/20 1.00
LOXL2 Q9Y4K0 2/20 0.58
MAPT P10636 2/20 0.57
SMN1; SMN2 Q16637 6/20 0.56
RAB9A P51151 5/20 0.56
NPC1 O15118 4/20 0.56
MAPK1 P28482 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
HPGD P15428 3/20 0.54
KMT2A Q03164 3/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
STAT6 P42226 1/20 0.51
ALOX15 P16050 1/20 0.51

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
Hydrochloric Acid SCHEMBL5009762 0.98 UBE2T (0.96) UBE2TASIC3LOXL2MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL289191 0.98 UBE2T (0.96) UBE2TASIC3LOXL2MAPTSMN1; SMN2
Bromide SCHEMBL31511838 0.98 UBE2T (0.96) UBE2TASIC3LOXL2MAPTSMN1; SMN2
SCHEMBL3529770 0.84 UBE2T (0.72) UBE2TASIC3LOXL2MAPTSMN1; SMN2
SCHEMBL19372016 0.83 UBE2T (0.70) UBE2TASIC3MAPTSMN1; SMN2RAB9A
SCHEMBL226465 0.83 UBE2T (0.70) UBE2TASIC3MAPTSMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL12477869 0.82 UBE2T (0.70) UBE2TASIC3LOXL2MAPTSMN1; SMN2
SCHEMBL10743371 0.82 UBE2T (0.67) UBE2TASIC3LOXL2MAPTSMN1; SMN2
SCHEMBL10763327 0.81 UBE2T (0.68) UBE2TASIC3LOXL2MAPTSMN1; SMN2
Bromide SCHEMBL7601035 0.81 UBE2T (0.68) UBE2TASIC3MAPTSMN1; SMN2RAB9A

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 303 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2627631-B1 PYRROLIDINONES AS METAP2 INHIBITORS MERCK PATENT GMBH (DE) 2015-12-16 EP claimed
US-9133187-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2015-09-15 US claimed
EP-2681215-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-04-22 EP claimed
CN-102365337-A Water based non-chromated primers for structural bonding applications CYTEC TECH CORP 2012-02-29 CN claimed
WO-2011073269-A1 PIPERIDINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO claimed
US-20080207683-A1 BIARYL-SUBSTITUTED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. 2008-08-28 US claimed
WO-2008100622-A2 BIARYL-SUBSTITUTED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO claimed
EP-1412328-B1 DOLASTATIN 10 DERIVATIVES HOFFMANN LA ROCHE (CH) 2006-10-04 EP claimed
CN-1553897-A Dolastatin 10 derivatives - 2004-12-08 CN claimed
EP-1435352-A2 9-[(Substituted glycyl)amido]-6-(substituted)-5-hydroxy-6-deoxytetracyclines Wyeth Holdings Corporation (US) 2004-07-07 EP claimed
US-5466684-A 7-(substituted)-9-[(substituted glycyl)amido]-6-demethyl-6-deoxytetracyclines AMERICAN CYANAMID COMPANY (US) 1995-11-14 US claimed
US-5442059-A Antibiotics for mammalian and veterninary diseases AMERICAN CYANAMID COMPANY (US) 1995-08-15 US claimed
US-5420272-A 7-(substituted)-8-(substituted)-9-](substituted glycyl)amido]-6-demethyl-6-deoxytetracyclines AMERICAN CYANAMID COMPANY (US) 1995-05-30 US claimed
EP-0618190-A1 9-[(Substituted glycyl)amido]-6-(substituted)-5-hydroxy-6-deoxytetracyclines AMERICAN CYANAMID COMPANY (US) 1994-10-05 EP claimed
US-5328902-A Antibiotics AMERICAN CYANAMID CO. (US) 1994-07-12 US claimed
EP-0582788-A1 7-(Substituted)-9- (substituted glycyl)-amido)-6-demethyl-6-deoxytetracyclines AMERICAN CYANAMID COMPANY (US) 1994-02-16 EP claimed
EP-0582789-A1 Novel 7-(substituted)-8-(substituted)-9- (substituted glycyl)amido -6-demethyl-6-deoxytetracyclines AMERICAN CYANAMID COMPANY (US) 1994-02-16 EP claimed
US-4914213-A Indole derivatives and process for producing the same FUJI PHOTO FILM CO., LTD. (JP) 1990-04-03 US claimed
US-4707553-A Indole derivatives and process for producing the same FUJI PHOTO FILM CO., LTD. (JP) 1987-11-17 US claimed
US-4435576-A Process for the production of 2-amino-4-methyl-benzothiazole LONZA LTD. (CH) 1984-03-06 US claimed

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-20080207683-A1 BIARYL-SUBSTITUTED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S CTSS, CTSK, CTSZ UBE2T 1851/4885ASIC3 2449/4885LOXL2 1456/4885

“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.