SCHEMBL2292257

SCHEMBL2292257

Cc1cc(C)nc(Cc2ccc(Cl)cc2N)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
HTT P42858 1/20 0.45
CYP3A4 P08684 3/20 0.44
HSP90AA1 P07900 2/20 0.40
HSP90AB1 P08238 2/20 0.40
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGD P15428 2/20 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
SCHEMBL2289041 0.87 HSP90AA1 (0.39) NR4A2SMN1; SMN2HTTCYP3A4HSP90AA1
SCHEMBL2292203 0.80 HTT (0.38) SMN1; SMN2HTTCYP3A4ALDH1A1TDP1
SCHEMBL9629784 0.78 SMN1; SMN2 (0.56) SMN1; SMN2HTTCYP3A4HSP90AA1TSHR
SCHEMBL10504825 0.72 SMN1; SMN2 (0.38) NR4A2SMN1; SMN2HTTCYP3A4TSHR
SCHEMBL2285469 0.72 NR4A2 (0.44) NR4A2HSP90AA1TSHRALDH1A1CYP1A2
SCHEMBL5308864 0.72 ENPP2 (0.38) SMN1; SMN2HTTCYP3A4TSHRALDH1A1
SCHEMBL358331 0.72 CYP3A4 (0.54) SMN1; SMN2HTTCYP3A4TSHRALDH1A1
SCHEMBL29758099 0.72 CYP3A4 (0.54) SMN1; SMN2HTTCYP3A4TSHRALDH1A1
SCHEMBL1509541 0.71 CYP3A4 (0.50) SMN1; SMN2HTTCYP3A4TSHRALDH1A1
SCHEMBL11778076 0.69 CYP3A4 (0.56) SMN1; SMN2CYP3A4TSHRALDH1A1ALOX15

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 NR4A2 1515/4885SMN1; SMN2 3491/4885HTT 1936/4885

“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.