SCHEMBL6531028

SCHEMBL6531028

Cc1ccc(Cl)c(CN(CCC(=O)O)Cc2cccc(Cc3ccccc3)c2)c1F

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
S1PR1 P21453 5/20 0.36
RORC P51449 1/20 0.36
HTT P42858 2/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
OPRK1 P41145 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
LTA4H P09960 2/20 0.35
MEP1B Q16820 1/20 0.35
RIPK1 Q13546 1/20 0.35
BCL2L1 Q07817 1/20 0.35
BAK1 Q16611 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
SCHEMBL6513945 0.93 HTT (0.40) LMNAPKMRORCHTTMEN1
SCHEMBL6515016 0.85 LMNA (0.41) LMNAPKMHTTMEN1MAPT
SCHEMBL6510816 0.82 MEP1B (0.42) MEP1B
SCHEMBL6529658 0.81 HDAC1 (0.39) LMNAPKMRORCHTTBCL2L1
SCHEMBL6529661 0.81 HDAC1 (0.39) LMNAPKMRORCHTTBCL2L1
SCHEMBL6510100 0.81 FFAR1 (0.41) HTTMAPTMTNR1AMTNR1BLTA4H
SCHEMBL6531269 0.80 FFAR4 (0.38) MAPTMEP1B
SCHEMBL6511657 0.79 HDAC3 (0.50) LMNAHTTMEN1KMT2AOPRK1
SCHEMBL6512357 0.78 TAS2R14 (0.43) LMNAHTTMEN1KMT2AMTNR1A
SCHEMBL6510153 0.78 PKM (0.47) PKMHTTMEN1KMT2ARIPK1

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
WO-2005097100-A2 ANTIBACTERIAL AGENTS PROLYSIS LTD. (GB) 2005-10-20 WO disclosed