SCHEMBL3823501

SCHEMBL3823501

CN(C)C(=O)c1ccncc1-c1nc(-c2ccc(Cl)cc2)cs1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.54
KDM4E B2RXH2 5/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
LMNA P02545 1/20 0.54
CYP19A1 P11511 3/20 0.52
GRM1 Q13255 1/20 0.52
IDH1 O75874 1/20 0.52
NPC1 O15118 6/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
EIF4E P06730 5/20 0.46
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
AGTR1 P30556 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ABL1 P00519 1/20 0.43

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
SCHEMBL3815644 0.84 RAB9A (0.54) RAB9AKDM4ESMN1; SMN2LMNACYP19A1
SCHEMBL3814593 0.77 KDM4E (0.66) RAB9AKDM4ESMN1; SMN2LMNACYP19A1
SCHEMBL3813712 0.77 KDM4E (0.69) RAB9AKDM4ESMN1; SMN2LMNACYP19A1
SCHEMBL6646406 0.77 KDM4E (0.61) RAB9AKDM4ESMN1; SMN2LMNACYP19A1
SCHEMBL3824243 0.75 KDM4E (0.58) RAB9AKDM4ESMN1; SMN2LMNACYP19A1
SCHEMBL3821664 0.75 EIF4E (0.44) RAB9AKDM4EGRM1NPC1EIF4E
SCHEMBL12467643 0.74 RAB9A (0.59) RAB9AKDM4ESMN1; SMN2LMNAGRM1
SCHEMBL6627488 0.74 KDM4E (0.61) RAB9AKDM4ESMN1; SMN2LMNACYP19A1
SCHEMBL6647162 0.74 KDM4E (0.61) RAB9AKDM4ESMN1; SMN2LMNACYP19A1
SCHEMBL6647164 0.73 KDM4E (0.59) RAB9AKDM4ESMN1; SMN2LMNACYP19A1

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 4836/4885KDM4E 1126/4885SMN1; SMN2 4849/4885

“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.