SCHEMBL13807663

SCHEMBL13807663

CCOC(=O)Cc1csc(CC(=O)N2CCC(c3nc(-c4cc(C(C)(C)C)c(OC)c(C(C)(C)C)c4)c(Cl)s3)CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
NPC1 O15118 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 3/20 0.34
RAB9A P51151 1/20 0.34
TP53 P04637 2/20 0.34
POLB P06746 2/20 0.34
HPGD P15428 2/20 0.33
UBE2M P61081 1/20 0.33
DCUN1D1 Q96GG9 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL4312441 0.91 ALDH1A1 (0.35) MAPTGAANPC1MEN1KMT2A
SCHEMBL13807668 0.87 TP53 (0.33) MAPTMEN1KMT2AALDH1A1TP53
SCHEMBL14495645 0.87 SMN1; SMN2 (0.34) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL13807671 0.87 TP53 (0.33) MAPTMEN1KMT2AALDH1A1TP53
SCHEMBL13807709 0.83 GAA (0.33) MAPTGAAPKMNPC1MEN1
SCHEMBL13807721 0.81 TP53 (0.32) MAPTTP53POLBUBE2MDCUN1D1
SCHEMBL4320850 0.80 MAPT (0.34) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL13807678 0.79 UBE2M (0.32) MEN1KMT2AALDH1A1HPGDUBE2M
SCHEMBL13807677 0.79 UBE2M (0.32) MEN1KMT2AALDH1A1HPGDUBE2M
SCHEMBL13807604 0.79 CCR1 (0.34) MAPTTP53POLBUBE2MDCUN1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143413-A1 Thiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2009-06-04 US disclosed
US-20090143413-A1 Thiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2009-06-04 US disclosed
WO-2007064553-A2 THIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-06-07 WO 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-20090143413-A1 Thiazole Derivatives as CXCR3 Receptor Modulators CXCR3, CXCR1, CX3CR1 MAPT 4614/4885GAA 3937/4885PKM 2390/4885

“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.