SCHEMBL3815644

SCHEMBL3815644

COC(=O)c1ccncc1-c1nc(-c2ccc(Cl)cc2)cs1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
KDM4E B2RXH2 2/20 0.54
LMNA P02545 1/20 0.54
CYP19A1 P11511 4/20 0.52
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
NPC1 O15118 3/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPT P10636 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
IDH1 O75874 1/20 0.48
ABL1 P00519 1/20 0.46
EIF4E P06730 3/20 0.46
CDK5 Q00535 1/20 0.45
CDK5R1 Q15078 1/20 0.45

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
SCHEMBL3823501 0.84 RAB9A (0.54) RAB9ASMN1; SMN2KDM4ELMNACYP19A1
SCHEMBL6627488 0.79 KDM4E (0.61) RAB9ASMN1; SMN2KDM4ELMNACYP19A1
SCHEMBL7217216 0.78 RAB9A (0.71) RAB9ASMN1; SMN2KDM4ELMNACYP19A1
SCHEMBL3814593 0.77 KDM4E (0.66) RAB9ASMN1; SMN2KDM4ELMNACYP19A1
SCHEMBL3813712 0.77 KDM4E (0.69) RAB9ASMN1; SMN2KDM4ELMNACYP19A1
SCHEMBL6646406 0.77 KDM4E (0.61) RAB9ASMN1; SMN2KDM4ELMNACYP19A1
SCHEMBL21056631 0.76 SLC6A4 (0.52) RAB9ASMN1; SMN2KDM4ECYP19A1SLC6A4
SCHEMBL3824243 0.75 KDM4E (0.58) RAB9ASMN1; SMN2KDM4ELMNACYP19A1
SCHEMBL6647162 0.74 KDM4E (0.61) RAB9ASMN1; SMN2KDM4ELMNACYP19A1
SCHEMBL3818231 0.74 KDM4E (0.51) RAB9ASMN1; SMN2KDM4ELMNACYP19A1

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
EP-1348706-B1 SUBSTITUTED THIAZOLE DERIVATIVES BEARING 3-PYRIDYL GROUPS, PROCESS FOR PREPARING THE SAME AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2009-08-19 EP disclosed
US-7067537-B2 Substituted thiazole derivatives bearing 3-pyridyl groups, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-27 US disclosed
US-20040072876-A1 Substituted thiazole derivatives bearing 3-pyridyl groups, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-15 US disclosed
EP-1348706-A1 SUBSTITUTED THIAZOLE DERIVATIVES BEARING 3-PYRIDYL GROUPS, PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-10-01 EP 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-20040072876-A1 Substituted thiazole derivatives bearing 3-pyridyl groups, process for preparing the same and use thereof CYP17A1, CYP21A2, HSD17B1 RAB9A 4836/4885SMN1; SMN2 4849/4885KDM4E 1126/4885

“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.