SCHEMBL12658283

SCHEMBL12658283

CCNC(=O)c1[nH]cc(-c2c[nH]c3c2=CC(Cl)C(Cl)C=3)c1-c1c[nH]c2ccc(Cl)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.42
▸ PYGL P06737 1/20 0.39
▸ MTNR1A P48039 1/20 0.38
▸ MTNR1B P49286 1/20 0.38
▸ GFER P55789 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ NR4A2 P43354 1/20 0.36
▸ NHERF1 O14745 2/20 0.36
▸ ALOX15 P16050 1/20 0.35
▸ F7 P08709 1/20 0.35
▸ F3 P13726 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ MMP8 P22894 1/20 0.35
▸ MMP14 P50281 1/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ SNCA P37840 2/20 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
SCHEMBL12658026 0.86 NR4A2 (0.48) PYGLMTNR1AMTNR1BHSD17B10NR4A2
SCHEMBL12658136 0.85 F7 (0.45) NR4A2NHERF1F7F3GABRP
SCHEMBL12658119 0.81 TSHR (0.47) TSHRPYGLMTNR1AMTNR1BGFER
SCHEMBL12658207 0.79 NR4A2 (0.45) PYGLMTNR1AMTNR1BHSD17B10NR4A2
SCHEMBL12658121 0.76 IGF1R (0.37) TSHRMTNR1AMTNR1BHSD17B10NR4A2
SCHEMBL12658115 0.73 NR4A2 (0.45) PYGLNR4A2F7F3
SCHEMBL12658015 0.72 F7 (0.42) NR4A2NHERF1F7F3
SCHEMBL12658126 0.71 NR4A2 (0.44) PYGLGFERHSD17B10NR4A2F7
SCHEMBL12658116 0.71 NR4A2 (0.44) PYGLNR4A2F7F3
Lynamicin A SCHEMBL12658027 0.70 NR4A2 (0.61) PYGLMTNR1AMTNR1BGFERHSD17B10

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
EP-1711486-B1 BIS-INDOLE PYRROLES USEFUL AS ANTIMICROBIAL AGENTS NEREUS PHARMACEUTICALS INC (US) 2011-05-11 — — EP disclosed
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