SCHEMBL6401098

SCHEMBL6401098

NN1C(=O)CN(c2ccccc2)C1=S

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.54
RAB9A P51151 4/20 0.54
KMT2A Q03164 4/20 0.54
MAPT P10636 3/20 0.50
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
CTSG P08311 2/20 0.41
CMA1 P23946 1/20 0.41
ATM Q13315 1/20 0.39
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
ALDH1A1 P00352 2/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 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
SCHEMBL6107438 0.80 NPC1 (0.54) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL1685398 0.78 KMT2A (0.56) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL11066753 0.77 NPC1 (0.54) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL9834330 0.74 KMT2A (0.61) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL11064251 0.73 KMT2A (0.50) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL10383197 0.73 NPC1 (0.50) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL11070922 0.73 KMT2A (0.50) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL11067037 0.72 GSK3A (0.51) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL11072116 0.70 KMT2A (0.49) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL11074111 0.70 KMT2A (0.48) NPC1RAB9AKMT2AMAPTKDM4E

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US claimed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP claimed
US-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US disclosed
EP-1078266-B1 HUMAN CHROMOGRANIN A (GgA) IMMUNOLOGIC ASSAY, ANTIBODIES, REAGENTS AND KITS FOR SAID ASSAY CIS BIO INT (FR) 2004-11-17 EP disclosed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP disclosed
US-6632624-B1 Use immunoassay for precise measurement of levels of intact chromogranin A and the levels of major fragments found in circulating blood CIS BIO INTERNATIONAL (FR) 2003-10-14 US disclosed
EP-1078266-A1 HUMAN CHROMOGRANIN A (GgA) IMMUNOLOGIC ASSAY, ANTIBODIES, REAGENTS AND KITS FOR SAID ASSAY CIS BIO INTERNATIONAL (FR) 2001-02-28 EP disclosed
WO-1999058980-A1 HUMAN CHROMOGRANIN A (GgA) IMMUNOLOGIC ASSAY, ANTIBODIES, REAGENTS AND KITS FOR SAID ASSAY CIS BIO INTERNATIONAL (FR) 1999-11-18 WO disclosed
US-5981264-A PURE MICROORGANISM CULTURES PRODUCING FUNGICIDES; FOR TREATMENT OF PLANT DISEASE OR EFFECTIVE AS USE AS HERBICIDES THE RESEARCH AND DEVELOPMENT INSTITUTE, INC. AT MONTANA STATE UNIVERSITY (US) 1999-11-09 US disclosed
US-5837685-A PSEUDOMYCIN RESEARCH AND DEVELOPMENT INSTITUTE INC. AT MONTANA STATE UNIVERSITY (US) 1998-11-17 US disclosed
US-5576298-A PSEUDOMYCIN RESEARCH AND DEVELOPMENT INSTITUTE, INC. AT MONTANA STATE UNIVERSITY (US) 1996-11-19 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-20050054696-A1 Indole compounds and medicinal use thereof IDO1, GPR119, SLC5A1 NPC1 706/4885RAB9A 1891/4885KMT2A 673/4885

“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.