SCHEMBL3677538

SCHEMBL3677538

Cc1nc2ncnn2cc1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPK1 P28482 1/20 0.41
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
DHFR P00374 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
AHR P35869 4/20 0.38
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 2/20 0.37
TGFBR1 P36897 1/20 0.37
CYP2C19 P33261 1/20 0.36
CHRM5 P08912 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
SCHEMBL3679921 0.76 DGAT1 (0.39) KDM4EALDH1A1MAPK1NPC1RAB9A
SCHEMBL373769 0.70 MAP3K14 (0.48) KDM4EALDH1A1RAB9AHPGD
SCHEMBL259260 0.68 ALDH1A1 (0.49) KDM4EALDH1A1MAPK1NPC1SMN1; SMN2
SCHEMBL6998719 0.67 SMN1; SMN2 (0.38) KDM4EALDH1A1MAPK1NPC1RAB9A
SCHEMBL867191 0.66 SRC (0.39) KDM4EALDH1A1MAPK1NPC1RAB9A
SCHEMBL25276442 0.65 GAA (0.39) KDM4EALDH1A1MAPK1GAACYP2C19
SCHEMBL17067049 0.63 EIF4E (0.50) KDM4EALDH1A1MAPK1DHFRNPC1
SCHEMBL25722829 0.63 GAA (0.37) KDM4EALDH1A1MAPK1GAACYP2C19
SCHEMBL23510052 0.61 GAA (0.35) KDM4EALDH1A1MAPK1RAB9ASMN1; SMN2
SCHEMBL25729719 0.61 GAA (0.35) KDM4EALDH1A1MAPK1GAACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299262-B2 Pyridylmethyl-sulfonamide compounds BASF SE (DE) 2012-10-30 US disclosed
US-20100249077-A1 Pyridylmethyl-Sulfonamide Compounds BASF SE (DE) 2010-09-30 US 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-20100249077-A1 Pyridylmethyl-Sulfonamide Compounds CBR3, CBR1, CBS KDM4E 2704/4885ALDH1A1 1178/4885MAPK1 1442/4885

“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.