SCHEMBL8104001

SCHEMBL8104001

CN(Cc1ccc(Cl)cc1)C(=O)N1CCN(S(=O)(=O)N[C@H](CO)C(N)=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.44
TPSAB1 Q15661 1/20 0.41
LMNA P02545 1/20 0.39
KMT2A Q03164 3/20 0.38
LSS P48449 2/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 2/20 0.38
MEN1 O00255 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
DPP7 Q9UHL4 1/20 0.37
PKM P14618 1/20 0.36
CCR1 P32246 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
RORC P51449 1/20 0.35
MMP1 P03956 1/20 0.35
MMP3 P08254 1/20 0.35
MMP13 P45452 1/20 0.35

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
SCHEMBL8103998 0.82 HRH3 (0.43) HRH3TPSAB1LMNAKMT2ALSS
SCHEMBL8104006 0.79 TPSAB1 (0.41) HRH3TPSAB1LMNAKMT2ALSS
SCHEMBL8550694 0.77 MEN1 (0.48) LMNAKMT2AALDH1A1MEN1HTT
SCHEMBL8103946 0.72 LMNA (0.58) LMNAKMT2AALDH1A1MEN1HTT
SCHEMBL8096415 0.71 MMP12 (0.45) LMNAPOLBRAB9AMMP1MMP13
SCHEMBL9566226 0.65 LMNA (0.50) LMNAKMT2APOLBHTTRAB9A
Hydrochloric Acid SCHEMBL8701160 0.64 LMNA (0.49) LMNAKMT2APOLBHTTRAB9A
SCHEMBL8096541 0.64 FAAH (0.51) KMT2A
SCHEMBL4674825 0.64 KMT2A (0.57) HRH3LMNAKMT2AALDH1A1POLB
SCHEMBL4674822 0.64 KMT2A (0.57) HRH3LMNAKMT2AALDH1A1POLB

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-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed
US-5998412-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS SYNTEX (U.S.A.) INC. (US) 1999-12-07 US disclosed