SCHEMBL3824243

SCHEMBL3824243

CC(C)(O)c1ccncc1-c1nc(-c2ccc(Cl)cc2)cs1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.58
RAB9A P51151 5/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
LMNA P02545 3/20 0.58
CYP19A1 P11511 3/20 0.52
NPC1 O15118 4/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PLAU P00749 3/20 0.45
C1S P09871 1/20 0.45
SREBF2 Q12772 1/20 0.44
MAPT P10636 1/20 0.43
ATM Q13315 1/20 0.43
CYP1A1 P04798 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP1B1 Q16678 1/20 0.42
AR P10275 1/20 0.42

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
SCHEMBL6786537 0.85 KDM4E (0.61) KDM4ERAB9ASMN1; SMN2LMNACYP19A1
SCHEMBL3814593 0.80 KDM4E (0.66) KDM4ERAB9ASMN1; SMN2LMNACYP19A1
SCHEMBL3813712 0.80 KDM4E (0.69) KDM4ERAB9ASMN1; SMN2LMNACYP19A1
SCHEMBL6647162 0.77 KDM4E (0.61) KDM4ERAB9ASMN1; SMN2LMNACYP19A1
SCHEMBL6627488 0.77 KDM4E (0.61) KDM4ERAB9ASMN1; SMN2LMNACYP19A1
SCHEMBL6646406 0.77 KDM4E (0.61) KDM4ERAB9ASMN1; SMN2LMNACYP19A1
SCHEMBL6648869 0.77 EIF4E (0.55) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL6647164 0.76 KDM4E (0.59) KDM4ERAB9ASMN1; SMN2LMNACYP19A1
SCHEMBL3815644 0.75 RAB9A (0.54) KDM4ERAB9ASMN1; SMN2LMNACYP19A1
SCHEMBL3823501 0.75 RAB9A (0.54) KDM4ERAB9ASMN1; 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 KDM4E 1126/4885RAB9A 4836/4885SMN1; 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.