SCHEMBL2285486

SCHEMBL2285486

Cc1cc(C)nc(C(C)c2cccc(Cl)c2N)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.43
HSP90AA1 P07900 5/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
NFKB1 P19838 1/20 0.39
PNMT P11086 1/20 0.39
LMNA P02545 3/20 0.38
ALDH1A1 P00352 2/20 0.38
GLA P06280 1/20 0.38
HSP90AB1 P08238 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NR4A1 P22736 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL2286528 0.86 CYP1A2 (0.40) NR4A2HSP90AA1CYP1A2CYP3A4CYP2D6
SCHEMBL2289493 0.84 NR4A2 (0.43) NR4A2HSP90AA1CYP1A2CYP3A4CYP2D6
SCHEMBL2288298 0.83 NR4A2 (0.42) NR4A2HSP90AA1CYP1A2CYP3A4CYP2D6
SCHEMBL2282987 0.83 NR4A2 (0.42) NR4A2HSP90AA1CYP1A2CYP3A4CYP2D6
SCHEMBL2289428 0.81 KMT2A (0.35) CYP1A2CYP2D6LMNAALDH1A1MEN1
SCHEMBL5502566 0.81 NR4A2 (0.40) NR4A2HSP90AA1CYP1A2CYP3A4CYP2D6
SCHEMBL2286349 0.81 NR4A2 (0.40) NR4A2HSP90AA1CYP1A2CYP3A4CYP2D6
SCHEMBL2286974 0.81 HSP90AA1 (0.41) HSP90AA1CYP1A2CYP3A4CYP2D6NFKB1
SCHEMBL5498727 0.80 NR4A2 (0.39) NR4A2HSP90AA1CYP1A2CYP3A4CYP2D6
SCHEMBL1170186 0.79 CYP1A2 (0.52) NR4A2CYP1A2CYP3A4CYP2D6NFKB1

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 1515/4885HSP90AA1 3876/4885CYP1A2 41/4885

“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.