SCHEMBL2289395

SCHEMBL2289395

COc1cc(OC)nc(C(=O)c2cc(Cl)cc(Cl)c2N)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.43
GAA P10253 10/20 0.43
KDM4E B2RXH2 9/20 0.43
GLA P06280 7/20 0.43
HPGD P15428 8/20 0.43
HSD17B10 Q99714 2/20 0.41
MAPT P10636 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
POLB P06746 1/20 0.40
ESR2 Q92731 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
NQO2 P16083 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
CYP1A2 P05177 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL2283801 0.86 CYP1A2 (0.35) ALDH1A1KDM4ENPSR1NPC1RAB9A
SCHEMBL2286914 0.86 ALDH1A1 (0.35) ALDH1A1GAAKDM4EHPGDHSD17B10
SCHEMBL2289383 0.83 NPSR1 (0.47) ALDH1A1GAAKDM4ENPSR1POLB
SCHEMBL2288581 0.80 SMN1; SMN2 (0.40) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL2283859 0.79 NPSR1 (0.44) ALDH1A1GAAKDM4EMAPTNPSR1
SCHEMBL2289672 0.78 NPC1 (0.37) ALDH1A1HPGDHSD17B10NPSR1POLB
SCHEMBL2282974 0.78 SMN1; SMN2 (0.38) ALDH1A1HPGDHSD17B10NPSR1POLB
SCHEMBL2284904 0.75 ALDH1A1 (0.38) ALDH1A1KDM4EHPGDHSD17B10NPSR1
SCHEMBL2291581 0.74 CYP1A2 (0.36) ALDH1A1GAAKDM4EPOLBCYP1A2
SCHEMBL2289019 0.74 NNMT (0.38) ALDH1A1GAAKDM4EPOLBNPC1

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
EP-1773124-B1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE BAYER CROPSCIENCE AG (DE) 2012-08-22 EP disclosed
US-8008484-B2 Use of sulfonanilides as agricultural and horticultural fungicide BAYER CROPSCIENCE AG (DE) 2011-08-30 US disclosed
US-20070219199-A1 Use of Sulfonanilides as Agricultural and Horticultural Fungicide BAYER CROPSCIENCE AG (DE) 2007-09-20 US disclosed
EP-1773124-A1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE Bayer CropScience Aktiengesellschaft (DE) 2007-04-18 EP disclosed
WO-2006008159-A1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE BAYER CROPSCIENCE AG (DE) 2006-01-26 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-20070219199-A1 Use of Sulfonanilides as Agricultural and Horticultural Fungicide CBR3, CYP51A1, CBR1 ALDH1A1 1037/4885GAA 2292/4885KDM4E 1374/4885

“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.