SCHEMBL3663594

SCHEMBL3663594

CCC(C(=O)O)c1ccccc1N(Cl)Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ KCNQ2 O43526 1/20 0.37
▸ TSHR P16473 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ AKR1C3 P42330 4/20 0.35
▸ AKR1C2 P52895 4/20 0.35
▸ AKR1C1 Q04828 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ CYP2C19 P33261 1/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL3666337 0.82 CYSLTR2 (0.41) ALDH1A1
SCHEMBL3665483 0.82 CYSLTR2 (0.41) ALDH1A1
SCHEMBL10411263 0.81 EGFR (0.40) LMNAHSD17B10MEN1KMT2AKCNQ2
SCHEMBL8998356 0.80 MEN1 (0.47) LMNAHSD17B10MEN1KMT2AKCNQ2
SCHEMBL1489632 0.77 KCNQ2 (0.50) LMNAHSD17B10MEN1KMT2AKCNQ2
SCHEMBL30821928 0.77 KCNQ2 (0.50) LMNAHSD17B10MEN1KMT2AKCNQ2
SCHEMBL10580121 0.75 LMNA (0.41) LMNAHSD17B10MEN1KMT2AKCNQ2
SCHEMBL4062734 0.75 LMNA (0.41) LMNAHSD17B10KMT2ATSHRCYP1A2
SCHEMBL4071095 0.75 TSHR (0.57) LMNAHSD17B10TSHRCYP1A2AKR1C3
SCHEMBL19946640 0.75 CRHBP (0.44) LMNAHSD17B10MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2235202-B1 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE BIOMERIEUX SA (FR) 2013-06-19 — — EP disclosed
US-8404460-B2 Method for detecting and/or identifying Clostridium difficile BIOMERIEUX (FR) 2013-03-26 — — US disclosed
US-20100279330-A1 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE BIOMERIEUX (FR) 2010-11-04 — — US disclosed
EP-2235202-A2 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE Biomérieux (FR) 2010-10-06 — — EP disclosed
WO-2009092982-A2 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE bioMérieux (FR) 2009-07-30 — — WO disclosed
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