SCHEMBL14804142

SCHEMBL14804142

CCc1ccc(OCCO[Si](C)(C)C(C)(C)C)c(Br)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.45
TP53 P04637 4/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
HPGD P15428 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 4/20 0.42
HSD17B10 Q99714 2/20 0.42
USP2 O75604 1/20 0.42
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP2D6 P10635 1/20 0.40
KMT2A Q03164 1/20 0.39
CYP2C9 P11712 1/20 0.36
HSP90AA1 P07900 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
S1PR2 O95136 1/20 0.35
S1PR1 P21453 1/20 0.35

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
SCHEMBL14804154 0.84 KDM4E (0.38) RAB9ASMN1; SMN2ALDH1A1KMT2AKDM4E
SCHEMBL24344107 0.83 CYP1A2 (0.52) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL15730502 0.82 L3MBTL1 (0.41) MAPTTP53NPC1RAB9AHPGD
SCHEMBL12134834 0.82 PKM (0.46) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL12134837 0.82 S1PR4 (0.49) MAPTTP53NPC1RAB9AHPGD
SCHEMBL31573413 0.82 PKM (0.46) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL3363345 0.81 ALDH1A1 (0.37) MAPTRAB9AHPGDSMN1; SMN2ALDH1A1
SCHEMBL12377755 0.80 L3MBTL1 (0.40) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL13125213 0.79 NPC1 (0.41) MAPTTP53NPC1HPGDSMN1; SMN2
SCHEMBL15708682 0.78 FDPS (0.48) MAPTNPC1RAB9AHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765764-B2 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA, INC. (JP) 2014-07-01 US disclosed
US-20130079351-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA, INC. (JP) 2013-03-28 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 (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-20130079351-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF MPL, JAK2, ABL1 MAPT 4550/4885TP53 2041/4885NPC1 2554/4885

“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.