SCHEMBL25007722

SCHEMBL25007722

CCCC(C)(C)OC(=O)c1cnccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
MAPT P10636 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
TSHR P16473 2/20 0.44
POLB P06746 2/20 0.44
NAPRT Q6XQN6 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
USP2 O75604 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
MC4R P32245 1/20 0.42
ADRA1A P35348 1/20 0.42
MC3R P41968 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
TP53 P04637 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL15012747 0.90 KDM4E (0.50) KDM4EMAPTTDP1TSHRPOLB
SCHEMBL25006751 0.88 KDM4E (0.47) KDM4EMAPTTDP1TSHRPOLB
SCHEMBL29444266 0.80 KDM4E (0.52) KDM4EMAPTTDP1TSHRPOLB
SCHEMBL2929844 0.80 KDM4E (0.52) KDM4EMAPTTDP1TSHRPOLB
SCHEMBL18387859 0.76 KDM4E (0.47) KDM4EMAPTTDP1TSHRPOLB
SCHEMBL28042095 0.75 L3MBTL1 (0.57) KDM4EMAPTTDP1TSHRPOLB
Ethoxycarbonyl Group SCHEMBL27792186 0.74 KMT2A (0.43) KDM4EMAPTTDP1TSHRPOLB
SCHEMBL8408307 0.74 MAPT (0.63) KDM4EMAPTTDP1TSHRPOLB
SCHEMBL30568667 0.74 POLB (0.61) KDM4EMAPTTDP1TSHRPOLB
SCHEMBL2558377 0.74 POLB (0.61) KDM4EMAPTTDP1TSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230041563-A1 N-(1,3,4-OXADIAZOL-2-YL)ARYLCARBOXAMIDES OR SALTS THEREOF, PREPARATION METHODS, HERBICIDAL COMPOSITIONS AND USES THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2023-02-09 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-20230041563-A1 N-(1,3,4-OXADIAZOL-2-YL)ARYLCARBOXAMIDES OR SALTS THEREOF, PREPARATION METHODS, HERBICIDAL COMPOSITIONS AND USES THEREOF CYP2B6, CBR3, CYP2A6 KDM4E 1891/4885MAPT 4640/4885TDP1 4690/4885

“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.