SCHEMBL1665725

SCHEMBL1665725

CCC(Oc1ccc(C(=O)OC)cc1Cl)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
MAPT P10636 3/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
TSHR P16473 1/20 0.43
TAS1R3 Q7RTX0 4/20 0.42
TAS1R1 Q7RTX1 4/20 0.42
PDK1 Q15118 2/20 0.42
PDK2 Q15119 2/20 0.42
PDK3 Q15120 2/20 0.42
PDK4 Q16654 2/20 0.42
ALDH1A1 P00352 3/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL2015571 0.80 MAPT (0.48) SMN1; SMN2MAPTKMT2AMEN1NPC1
SCHEMBL1665723 0.78 SMN1; SMN2 (0.44) SMN1; SMN2MAPTKMT2AMEN1NPC1
SCHEMBL1015712 0.77 RORC (0.57) SMN1; SMN2MAPTKMT2AMEN1NPC1
SCHEMBL11653769 0.76 MAPT (0.44) SMN1; SMN2MAPTKMT2AMEN1NPC1
SCHEMBL25212586 0.76 MAPT (0.52) SMN1; SMN2MAPTKMT2AMEN1NPC1
SCHEMBL1398536 0.74 MEN1 (0.59) SMN1; SMN2MAPTKMT2AMEN1NPC1
SCHEMBL10088912 0.74 RORC (0.62) SMN1; SMN2MAPTKMT2AMEN1NPC1
SCHEMBL5152500 0.73 KMT2A (0.49) SMN1; SMN2MAPTKMT2AMEN1NPC1
Methyl 3-Chloro-4-Methoxybenzoate SCHEMBL1637523 0.73 KMT2A (0.69) SMN1; SMN2MAPTKMT2AMEN1NPC1
Methyl 3-Chloro-4-Methoxybenzoate SCHEMBL31296522 0.73 KMT2A (0.69) SMN1; SMN2MAPTKMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2314586-B1 2-Acylaminothiazole derivative or salt thereof ASTELLAS PHARMA INC (JP) 2016-09-14 EP disclosed
US-8765764-B2 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA, INC. (JP) 2014-07-01 US disclosed
EP-1466912-B1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2013-04-24 EP disclosed
US-20130079351-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA, INC. (JP) 2013-03-28 US disclosed
US-8338429-B2 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA, INC. (JP) 2012-12-25 US disclosed
EP-2314586-A1 2-Acylaminothiazole derivative or salt thereof Astellas Pharma Inc. (JP) 2011-04-27 EP disclosed
US-20100222329-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2010-09-02 US disclosed
US-20100222361-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2010-09-02 US disclosed
US-7638536-B2 N-[4-(4-chlorothiophen-2-yl)-5-(4-cyclohexylpiperazin-1-yl)thiazol-2-yl]-3-fluoro-4-hydroxybenzamide; nonpeptide c-mpl ligand; low immunogenicity; proliferate human c-mpl-Ba/F3 cells; increase platelets by promoting the formation of megakaryocytic colonies; orally ASTELLAS PHARMA INC. (JP) 2009-12-29 US disclosed
US-20050153977-A1 2-Acylaminothiazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2005-07-14 US disclosed
EP-1466912-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2004-10-13 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 (4 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-20050153977-A1 2-Acylaminothiazole derivative or salt thereof MPL, JAK2, ABL1 SMN1; SMN2 967/4885MAPT 4550/4885KMT2A 206/4885
US-20130079351-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF MPL, JAK2, ABL1 SMN1; SMN2 967/4885MAPT 4550/4885KMT2A 206/4885
US-20100222329-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF MPL, JAK2, ABL1 SMN1; SMN2 967/4885MAPT 4550/4885KMT2A 206/4885
US-20100222361-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF MPL, JAK2, ABL1 SMN1; SMN2 967/4885MAPT 4550/4885KMT2A 206/4885

“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.