SCHEMBL5355484

SCHEMBL5355484

NC(=S)c1ccc2[nH]ncc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 4/20 0.55
ROCK1 Q13464 3/20 0.55
RAB9A P51151 2/20 0.55
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
KMT2A Q03164 1/20 0.55
HIF1A Q16665 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
CTNNB1 P35222 6/20 0.51
WNT3A P56704 6/20 0.51
NOS1 P29475 3/20 0.50
METAP2 P50579 1/20 0.50
CSNK2A1 P68400 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.46
GSK3B P49841 2/20 0.46
JAK2 O60674 1/20 0.46

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
SCHEMBL1419814 0.82 AR (0.63) ROCK2ROCK1RAB9AKDM4EMEN1
SCHEMBL5799577 0.82 AR (0.63) ROCK2ROCK1RAB9AKDM4EMEN1
SCHEMBL29949712 0.82 AR (0.63) ROCK2ROCK1RAB9AKDM4EMEN1
SCHEMBL12808894 0.82 ROCK2 (0.55) ROCK2ROCK1RAB9AKDM4EMEN1
Hydrochloric Acid SCHEMBL30177200 0.81 AR (0.61) ROCK2ROCK1RAB9AKDM4EMEN1
Hydrochloric Acid SCHEMBL14994256 0.81 AR (0.61) ROCK2ROCK1RAB9AKDM4EMEN1
SCHEMBL12601125 0.79 ROCK2 (0.51) ROCK2ROCK1RAB9AKDM4EMEN1
SCHEMBL774795 0.79 ROCK2 (0.51) ROCK2ROCK1RAB9AKDM4EMEN1
SCHEMBL774794 0.79 ROCK2 (0.51) ROCK2ROCK1RAB9AKDM4EMEN1
SCHEMBL4399578 0.79 ROCK2 (0.51) ROCK2ROCK1RAB9AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
EP-1483263-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2004-12-08 EP disclosed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US disclosed
US-20040039029-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-02-26 US disclosed
US-6645990-B2 For prophylaxis and therapy of diseases, such as cell proliferation or apoptosis mediated diseases AMGEN INC. 2003-11-11 US disclosed
WO-2003070727-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2003-08-28 WO disclosed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 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 (3 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-20020193405-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX ROCK2 4514/4885ROCK1 3731/4885RAB9A 3370/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX ROCK2 4514/4885ROCK1 3731/4885RAB9A 3370/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX ROCK2 4514/4885ROCK1 3731/4885RAB9A 3370/4885

“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.