SCHEMBL3593391

SCHEMBL3593391

CC1(C)Cc2cccc([NH])c2NC1=O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.36
PPARG P37231 2/20 0.36
NCOR2 Q9Y618 2/20 0.36
PRNP P04156 1/20 0.36
PDK2 Q15119 3/20 0.34
PDK4 Q16654 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PDK1 Q15118 1/20 0.33
PDK3 Q15120 1/20 0.33
KMT2A Q03164 1/20 0.32
AHR P35869 1/20 0.32
LMNA P02545 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
BRD4 O60885 1/20 0.30
CREBBP Q92793 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
SCHEMBL3593393 0.79 RXFP1 (0.36) RXFP1PPARGNCOR2PRNPPDK2
SCHEMBL3593720 0.74 PDK2 (0.39) PDK2PDK4ALDH1A1KMT2ALMNA
SCHEMBL30100699 0.71 PDK2 (0.48) RXFP1PPARGNCOR2PRNPPDK2
SCHEMBL6220027 0.71 PDK2 (0.48) RXFP1PPARGNCOR2PRNPPDK2
SCHEMBL3593737 0.69 NPC1 (0.50) PDK2AHRKDM4E
SCHEMBL3587265 0.69 BRD4 (0.54) AHRBRD4CREBBP
SCHEMBL3595402 0.68 BRD4 (0.37) PDK2PDK4ALDH1A1PDK1PDK3
SCHEMBL3639275 0.68 CA12 (0.37) AHR
SCHEMBL3605239 0.67 MAOA (0.37) ALDH1A1AHRKDM4E
SCHEMBL3594228 0.66 BRD4 (0.35) RXFP1PPARGNCOR2PRNPPDK2

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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 RXFP1 432/4885PPARG 2100/4885NCOR2 125/4885

“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.