SCHEMBL4929960

SCHEMBL4929960

Cc1cc(C)cc(N(S)C(N)=O)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TPMT P51580 1/20 0.38
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
C1S P09871 1/20 0.37
PRSS3 P35030 1/20 0.37
TSPO P30536 3/20 0.36
ALDH1A1 P00352 3/20 0.35
TSHR P16473 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX5 P09917 2/20 0.32
PARP1 P09874 1/20 0.32
PARP10 Q53GL7 1/20 0.32
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
KDM4E B2RXH2 1/20 0.31
AR P10275 1/20 0.30

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
SCHEMBL5634132 0.80 PARP1 (0.48) ALDH1A1CYP3A4PARP1
SCHEMBL3566684 0.78 ALOX5 (0.44) ALDH1A1TSHRALOX5
SCHEMBL15174259 0.78 KDM4E (0.39) TPMTPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL848354 0.78 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL220273 0.74
SCHEMBL10875825 0.74 TPMT (0.38) TPMTALDH1A1TSHRCYP3A4PARP1
SCHEMBL219166 0.74 PARP1 (0.32) ALOX5PARP1KDM4E
SCHEMBL725811 0.74 MAPT (0.32) ALDH1A1TSHRCYP3A4ALOX5PARP1
SCHEMBL4171297 0.74 ALDH1A1 (0.42) ALDH1A1TSHRALOX5PARP1PARP10
SCHEMBL11655480 0.74 ALDH1A1 (0.37) TPMTALDH1A1TSHRALOX5KDM4E

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
US-20080125432-A1 5-Carboxamido Substituted Thiazole Derivatives that Interact With Ion Channels, In Particular With Ion Channels From the Kv Family DEVGEN NV (BE) 2008-05-29 US disclosed
CN-101098698-A 5-carboxamido-substituted thiazole derivatives which interact with ion channels, in particular ion channels of the Kv family DEVGEN NV (BE) 2008-01-02 CN disclosed
EP-1819330-A1 5-CARBOXAMIDO SUBSTITUED THIAZOLE DERIVATIVES THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE KV FAMILY Devgen N.V. (BE) 2007-08-22 EP disclosed
WO-2006058905-A1 5-CARBOXAMIDO SUBSTITUTED THIAZOLE DERIVATIVES THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE Kv FAMILY DEVGEN NV (BE) 2006-06-08 WO 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-20080125432-A1 5-Carboxamido Substituted Thiazole Derivatives that Interact With Ion Channels, In Particular With Ion Channels From the Kv Family KCNA5, KCNA1, KCNJ2 TPMT 2480/4885PRSS1 2263/4885PRSS2 1425/4885

“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.