SCHEMBL7789368

SCHEMBL7789368

CCc1sc(C(=O)NO)cc1C1CCCCN1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.47
▸ EPHX2 P34913 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CCR2 P41597 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ HDAC6 Q9UBN7 2/20 0.41
▸ KDR P35968 2/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ UBE2M P61081 1/20 0.41
▸ DCUN1D1 Q96GG9 1/20 0.41
▸ GAA P10253 1/20 0.40

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
SCHEMBL12883063 0.76 TSHR (0.55) MAPTSMN1; SMN2NPSR1TSHRSLC6A3
SCHEMBL5950293 0.71 MAPT (0.63) MAPTEPHX2SMN1; SMN2NPSR1TSHR
SCHEMBL13375569 0.69 CCR1 (0.70) MAPTEPHX2SMN1; SMN2NPSR1TSHR
SCHEMBL13375442 0.68 CCR1 (0.80) MAPTEPHX2SMN1; SMN2TSHRLMNA
SCHEMBL13375973 0.68 CCR1 (0.80) MAPTEPHX2SMN1; SMN2TSHRLMNA
SCHEMBL7797507 0.68 HDAC6 (0.53) MAPTEPHX2SMN1; SMN2NPSR1SLC6A3
SCHEMBL7795783 0.68 HDAC6 (0.53) MAPTEPHX2SMN1; SMN2NPSR1SLC6A3
SCHEMBL13375445 0.67 CCR1 (0.79) MAPTSMN1; SMN2NPSR1TSHRSLC6A3
SCHEMBL13376006 0.67 CCR1 (0.79) MAPTSMN1; SMN2NPSR1TSHRSLC6A3
SCHEMBL13374943 0.67 CCR1 (0.79) MAPTEPHX2SMN1; SMN2TSHRSLC6A3

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-2010151317-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-12-29 — — WO disclosed
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