SCHEMBL7074110

SCHEMBL7074110

CCCc1ccc(S(=O)(=O)N2CCN(C(=O)c3cccc(C(=N)N)c3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
USP2 O75604 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
GAA P10253 2/20 0.51
ALDH1A1 P00352 1/20 0.51
TSHR P16473 1/20 0.51
PKM P14618 1/20 0.51
F10 P00742 1/20 0.50
KMT2A Q03164 2/20 0.48
GPR183 P32249 1/20 0.48
POLB P06746 1/20 0.48
CASP6 P55212 1/20 0.48
CASP8 Q14790 1/20 0.48
PLG P00747 3/20 0.47

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
Acetic Acid SCHEMBL27538656 0.97 USP2 (0.51) LMNASMN1; SMN2USP2L3MBTL1GAA
SCHEMBL7071611 0.89 F10 (0.59) LMNASMN1; SMN2L3MBTL1ALDH1A1TSHR
Acetic Acid SCHEMBL27525141 0.86 F10 (0.56) LMNASMN1; SMN2L3MBTL1ALDH1A1TSHR
SCHEMBL7074873 0.86 LMNA (0.48) LMNASMN1; SMN2ALDH1A1F10KMT2A
SCHEMBL7071911 0.84 L3MBTL1 (0.61) LMNAUSP2L3MBTL1GAAALDH1A1
Acetic Acid SCHEMBL27550401 0.83 LMNA (0.46) LMNASMN1; SMN2ALDH1A1PKMF10
SCHEMBL7074251 0.83 LMNA (0.66) LMNASMN1; SMN2L3MBTL1ALDH1A1TSHR
SCHEMBL7075851 0.83 USP2 (0.61) LMNASMN1; SMN2USP2L3MBTL1GAA
Acetic Acid SCHEMBL27550437 0.82 L3MBTL1 (0.57) LMNAUSP2L3MBTL1GAAALDH1A1
SCHEMBL7074761 0.82 LMNA (0.61) LMNASMN1; SMN2L3MBTL1ALDH1A1TSHR

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
EP-1025086-B1 BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GMBH (DE) 2003-06-25 EP disclosed
US-6492368-B1 Benzamidine derivatives as factor XA inhibitors MERCK PATENT GMBH (DE) 2002-12-10 US disclosed