SCHEMBL4940926

SCHEMBL4940926

Clc1ccc(C2CC(c3sccc3Cl)=NN2c2ccc(Cl)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 10/20 0.58
PTGS2 P35354 4/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 2/20 0.46
GLA P06280 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
ATM Q13315 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
S1PR2 O95136 1/20 0.46
S1PR4 O95977 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
GAA P10253 1/20 0.46
CYP2C9 P11712 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
SCHEMBL4946878 0.94 PRKCZ (0.56) PRKCZPTGS2CA1CA2L3MBTL1
SCHEMBL4949128 0.90 PTGS2 (0.59) PRKCZPTGS2CA1CA2L3MBTL1
SCHEMBL4945056 0.89 PTGS2 (0.64) PRKCZPTGS2CA1CA2CA12
SCHEMBL4940790 0.88 PRKCZ (0.56) PRKCZPTGS2CA1CA2EGFR
SCHEMBL4948095 0.86 MEN1 (0.61) PRKCZCA1CA2L3MBTL1KDM4E
SCHEMBL4946809 0.84 MAOB (0.59) PRKCZKDM4EALDH1A1EGFR
SCHEMBL4942223 0.83 ESD (0.55) PRKCZPTGS2CA1CA2L3MBTL1
SCHEMBL4947365 0.81 PRKCZ (0.42) PRKCZPTGS2CA1CA2EGFR
SCHEMBL16740617 0.74 PRKCZ (1.00) PRKCZPTGS2CA1CA2L3MBTL1
SCHEMBL3896190 0.71 PRKCZ (0.82) PRKCZCA1CA2L3MBTL1KDM4E

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-7435750-B2 Method of using substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2008-10-14 US disclosed
US-7041685-B2 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2006-05-09 US disclosed
US-20050154012-A1 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2005-07-14 US disclosed
EP-1406632-A2 SUBSTITUTED 3-ARYL-5-ARYL- 1,2,4]-OXADIAZOLES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF Cytovia, Inc. (US) 2004-04-14 EP disclosed
US-20030045546-A1 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2003-03-06 US disclosed
WO-2002100826-A2 SUBSTITUTED 3-ARYL-5-ARYL-[1,2,4]-OXADIAZOLES AND ANALOGS CYTOVIA, INC. (US) 2002-12-19 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 (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-20030045546-A1 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP3, CASP1, API5 PRKCZ 3643/4885PTGS2 2033/4885CA1 3257/4885
US-20050154012-A1 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP3, CASP1, CASP4 PRKCZ 3698/4885PTGS2 2222/4885CA1 3789/4885

“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.