SCHEMBL8868092

SCHEMBL8868092

COCCNC(=O)c1ccc(C(=O)NS(=O)(=O)c2cccc(C(=O)NC3CCCCC3)c2)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
HTR1A P08908 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
NFKB1 P19838 1/20 0.46
CNR1 P21554 1/20 0.46
CYP2C19 P33261 1/20 0.46
ADRA1A P35348 1/20 0.46
BLM P54132 1/20 0.46
HSD11B1 P28845 3/20 0.46
KMT2A Q03164 1/20 0.46
RAB9A P51151 2/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.45

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
SCHEMBL8869693 0.91 HSD17B10 (0.50) ALDH1A1HSD17B10HTTSMN1; SMN2LMNA
SCHEMBL8868847 0.91 ALDH1A1 (0.48) ALDH1A1HSD17B10HTTSMN1; SMN2LMNA
SCHEMBL8869950 0.90 LMNA (0.54) ALDH1A1HTTSMN1; SMN2LMNACYP3A4
SCHEMBL8869085 0.89 P4HTM (0.52) ALDH1A1MAPTKMT2ARAB9AHPGD
SCHEMBL9139277 0.88 ALDH1A1 (0.51) ALDH1A1HSD17B10HTTSMN1; SMN2LMNA
SCHEMBL7862847 0.87 ALDH1A1 (0.47) ALDH1A1HSD17B10HTTSMN1; SMN2KMT2A
SCHEMBL8869595 0.86 P4HTM (0.49) ALDH1A1HSD17B10MAPTCYP2C19KMT2A
SCHEMBL8869015 0.86 P4HTM (0.48) ALDH1A1SMN1; SMN2MAPTKMT2ARAB9A
SCHEMBL8869449 0.86 P4HTM (0.48) ALDH1A1HTTMAPTKMT2ARAB9A
SCHEMBL9140397 0.85 ALDH1A1 (0.51) ALDH1A1HSD17B10HTTSMN1; SMN2HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed