SCHEMBL3071395

SCHEMBL3071395

c1csc(-c2nc(-c3cc4ccccc4o3)cs2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 13/20 0.64
▸ KDM4E B2RXH2 6/20 0.64
▸ MEN1 O00255 5/20 0.64
▸ KMT2A Q03164 5/20 0.64
▸ TDP1 Q9NUW8 2/20 0.64
▸ POLB P06746 1/20 0.64
▸ CYP19A1 P11511 2/20 0.64
▸ RAB9A P51151 10/20 0.60
▸ NPC1 O15118 8/20 0.60
▸ HPGD P15428 3/20 0.59
▸ L3MBTL1 Q9Y468 2/20 0.59
▸ CASP3 P42574 1/20 0.59
▸ SENP8 Q96LD8 1/20 0.59
▸ SENP7 Q9BQF6 1/20 0.59
▸ SENP6 Q9GZR1 1/20 0.59
▸ SMN1; SMN2 Q16637 8/20 0.54
▸ STAT1 P42224 1/20 0.54
▸ ALDH1A1 P00352 9/20 0.54
▸ TP53 P04637 2/20 0.54
▸ TSHR P16473 2/20 0.54

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
SCHEMBL7852356 0.81 MAOB (0.61) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL21823774 0.81 CYP19A1 (0.69) MAPTKDM4EMEN1KMT2APOLB
SCHEMBL27935903 0.76 KDM4E (1.00) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL299473 0.76 CYP19A1 (0.58) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL5328162 0.75 NPC1 (1.00) MAPTKDM4EMEN1KMT2ACYP19A1
SCHEMBL21823816 0.75 CYP19A1 (0.61) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL8314667 0.75 MEN1 (0.52) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL12647915 0.74 NPC1 (0.69) MAPTKDM4ECYP19A1RAB9ANPC1
SCHEMBL10625602 0.73 KDM4E (0.73) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL14936927 0.73 MAPT (0.62) MAPTKDM4EMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795290-B2 2-amido-thiazole-based compounds exhibiting ATP-utilizing enzyme inhibitory activity, and compositions, and uses thereof GENENTECH, INC. (US) 2010-09-14 — — US disclosed
US-20090048313-A1 2-AMIDO-THIAZOLE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF GENENTECH, INC. (US) 2009-02-19 — — US disclosed
US-7410988-B2 2-Amido-thiazole-based compounds exhibiting ATP-utilizing enzyme inhibitory activity, and compositions, and uses thereof GENENTECH, INC. (US) 2008-08-12 — — US disclosed
US-20060052416-A1 2-Amido-thiazole-based compounds exhibiting ATP-utilizing enzyme inhibitory activity, and compositions, and uses thereof SQUARE 1 BANK 2006-03-09 — — 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 (2 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-20090048313-A1 2-AMIDO-THIAZOLE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF ATP5ME, ATP5MG, ATP5MK MAPT 3561/4885KDM4E 3385/4885MEN1 2593/4885
US-20060052416-A1 2-Amido-thiazole-based compounds exhibiting ATP-utilizing enzyme inhibitory activity, and compositions, and uses thereof ATP5ME, ATP5MG, ATP5MK MAPT 3561/4885KDM4E 3385/4885MEN1 2593/4885

“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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