SCHEMBL2880446

SCHEMBL2880446

Cc1cnc(NC(=O)C(C)(C)C)s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.56
NPC1 O15118 10/20 0.55
SMN1; SMN2 Q16637 8/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
PKM P14618 3/20 0.53
MAPT P10636 2/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
BLM P54132 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TP53 P04637 1/20 0.49
LMNA P02545 1/20 0.49
CCNB2 O95067 1/20 0.48

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
SCHEMBL5652094 0.84 RAB9A (0.54) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL3794688 0.81 RAB9A (0.62) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL9974179 0.81 SMN1; SMN2 (0.55) RAB9ANPC1SMN1; SMN2PKMMAPT
SCHEMBL2175131 0.79 RAB9A (0.60) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL3800102 0.79 CCNE1 (0.54) RAB9ANPC1SMN1; SMN2KMT2AMAPT
SCHEMBL12241503 0.78 RAB9A (0.52) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL18969626 0.78 RAB9A (0.57) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL13436511 0.78 CDK2 (0.67) SMN1; SMN2KMT2AMAPTGAAALDH1A1
SCHEMBL6474925 0.78 RAB9A (0.58) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL26818237 0.78 RAB9A (0.58) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10300061-B2 Aminothiazole compounds as protein kinase inhibitors NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2019-05-28 US disclosed
EP-2245020-B1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBVIE INC (US) 2014-01-15 EP disclosed
US-8383657-B2 Thiazolylidine urea and amide derivatives and methods of use thereof ABBOTT LABORATORIES (US) 2013-02-26 US disclosed
EP-2245020-A2 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF Abbott Laboratories (US) 2010-11-03 EP disclosed
WO-2009086163-A2 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-07-09 WO disclosed
US-20090163470-A1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-06-25 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-20090163470-A1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF NMUR1, NMUR2, PAM RAB9A 1612/4885NPC1 1253/4885SMN1; SMN2 1424/4885
US-10300061-B2 Aminothiazole compounds as protein kinase inhibitors ABL1, ERBB2, CSNK1E RAB9A 1830/4885NPC1 3726/4885SMN1; SMN2 4261/4885

“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.