SCHEMBL2372449

SCHEMBL2372449

O=S(=O)(NC1(c2ccccn2)CC1)c1ccc(Br)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
RXFP1 Q9HBX9 3/20 0.46
IKBKB O14920 1/20 0.40
ALDH1A1 P00352 3/20 0.40
FABP4 P15090 2/20 0.39
FABP5 Q01469 1/20 0.39
NPSR1 Q6W5P4 2/20 0.38
MAPK10 P53779 1/20 0.38
SLC40A1 Q9NP59 1/20 0.38
HPGD P15428 3/20 0.36
GRM4 Q14833 1/20 0.36
KDM4E B2RXH2 3/20 0.34
HSD17B10 Q99714 2/20 0.34
NSD2 O96028 1/20 0.34
TSHR P16473 1/20 0.34
CKS1B P61024 1/20 0.34
SKP2 Q13309 1/20 0.34
ADORA2A P29274 1/20 0.34
FTO Q9C0B1 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
SCHEMBL16819769 0.71 PARG (0.47) MEN1KMT2ARXFP1IKBKBFABP4
Pyrabactin A SCHEMBL29395044 0.70 L3MBTL1 (0.57) MEN1KMT2AIKBKBALDH1A1HPGD
SCHEMBL15549189 0.70 FABP4 (0.47) MEN1KMT2ARXFP1IKBKBFABP4
Pyrabactin A SCHEMBL30157573 0.70 L3MBTL1 (0.57) MEN1KMT2AIKBKBALDH1A1HPGD
Pyrabactin A SCHEMBL9932519 0.70 L3MBTL1 (0.57) MEN1KMT2AIKBKBALDH1A1HPGD
SCHEMBL2372874 0.67 RXFP1 (0.54) MEN1KMT2ARXFP1IKBKBALDH1A1
SCHEMBL2371075 0.66 RXFP1 (0.57) MEN1KMT2ARXFP1IKBKBALDH1A1
SCHEMBL712412 0.65 KMT2A (0.55) MEN1KMT2ARXFP1ALDH1A1FABP4
SCHEMBL15550601 0.65 NSD2 (0.57) MEN1KMT2ARXFP1IKBKBALDH1A1
SCHEMBL22234409 0.65 KMT2A (0.58) MEN1KMT2ARXFP1IKBKBFABP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2547204-A2 ARYL AND HETARYL SULFONAMIDES AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS Bayer Intellectual Property GmbH (DE) 2013-01-23 EP disclosed
US-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 US disclosed
US-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 US disclosed
US-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 US disclosed
WO-2011113861-A2 ARYL AND HETARYL SULFONAMIDES AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 WO disclosed
WO-2011113861-A2 ARYL AND HETARYL SULFONAMIDES AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 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-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS STS, ARSA, TST MEN1 4795/4885KMT2A 1543/4885RXFP1 4339/4885

“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.