SCHEMBL2281968

SCHEMBL2281968

Cc1cc(C)nc(C(=O)c2cccc(F)c2N)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MITF O75030 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
MDM2 Q00987 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HCRTR1 O43613 9/20 0.41
HCRTR2 O43614 9/20 0.41
CD38 P28907 3/20 0.41
CHRM4 P08173 1/20 0.39
GRM5 P41594 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
KCNH2 Q12809 2/20 0.37
CYP1A2 P05177 1/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
CES2 O00748 1/20 0.37

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
SCHEMBL2292844 0.88 CYP1A2 (0.40) MITFMAPTMAPK1MDM2NPSR1
SCHEMBL2289038 0.84 NPC1 (0.43) HCRTR1HCRTR2NPC1RAB9ACYP1A2
SCHEMBL2290737 0.81 ALDH1A1 (0.48) MAPTCD38MEN1KMT2AALDH1A1
SCHEMBL2285853 0.81 NPC1 (0.40) MEN1NPC1RAB9AKMT2ACYP1A2
SCHEMBL13837847 0.76 CDK2 (0.33) MAPTNPSR1MEN1NPC1RAB9A
SCHEMBL2289056 0.76 GAA (0.39) NPC1RAB9ACYP1A2
SCHEMBL15628169 0.75 POLB (0.58) MAPTNPC1RAB9AKMT2AALDH1A1
SCHEMBL15619489 0.74 AKR1C3 (0.53) MAPTMAPK1NPC1RAB9AALDH1A1
SCHEMBL30515953 0.72 KMT2A (0.49) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL4608420 0.72 KMT2A (0.49) MEN1NPC1RAB9AKMT2AALDH1A1

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 MITF 3775/4885MAPT 4582/4885MAPK1 2996/4885

“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.