SCHEMBL3199516

SCHEMBL3199516

Cc1cc(Cc2ccccc2)c(C(N)=O)c(N)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 3/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
USP2 O75604 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
RECQL P46063 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HSD17B10 Q99714 1/20 0.48
IKBKB O14920 3/20 0.43
PLA2G10 O15496 1/20 0.41
PLA2G2A P14555 1/20 0.41
BRD4 O60885 1/20 0.41
CYP1A2 P05177 1/20 0.41
CD38 P28907 1/20 0.41
TLR7 Q9NYK1 1/20 0.40
POLB P06746 1/20 0.40
CHRM4 P08173 1/20 0.39
LDHA P00338 1/20 0.39

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
SCHEMBL28780875 0.79 P2RX3 (0.54) IKBKB
SCHEMBL3217195 0.77 BRD4 (0.50) ALDH1A1KDM4EHPGDSMN1; SMN2USP2
SCHEMBL28790249 0.75 PLA2G10 (0.45) ALDH1A1HPGDUSP2MAPTALOX15
SCHEMBL28790250 0.75 IKBKB (0.54) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL27824628 0.74 RCE1 (0.49) ALDH1A1HPGDUSP2MAPTALOX15
SCHEMBL7257033 0.72 ADAM17 (0.55) ALDH1A1KDM4ESMN1; SMN2MAPTPLA2G10
SCHEMBL3946630 0.72 ADORA2A (0.45) ALDH1A1KDM4EHPGDSMN1; SMN2USP2
SCHEMBL13740601 0.72 ADORA2A (0.48) TLR7
SCHEMBL28790298 0.71 KDM4E (0.47) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL31295740 0.71 POLB (0.67) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101951771-A Composition for agricultural use for controlling or preventing plant diseases caused by plant pathogens SUMITOMO CHEMICAL CO 2011-01-19 CN disclosed
US-20100029710-A1 COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARy ACTIVATING ACTIVITIES PFIZER PRODUCTS INC. (US) 2010-02-04 US disclosed
CN-101600715-A Compound with angiotensin-ii receptor antagonistic action and PPAR γ activating activities PFIZER PROD INC (US) 2009-12-09 CN disclosed
EP-2125806-A1 COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARY ACTIVATING ACTIVITIES Pfizer Products Inc. (US) 2009-12-02 EP disclosed
WO-2008084303-A1 COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARY ACTIVATING ACTIVITIES PFIZER PRODUCTS INC. (US) 2008-07-17 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-20100029710-A1 COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARy ACTIVATING ACTIVITIES AGTR2, AGTR1, AGT ALDH1A1 1739/4885KDM4E 4566/4885HPGD 542/4885

“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.