SCHEMBL27488152

SCHEMBL27488152

CCCCC(=O)N(N)Cc1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 7/20 0.46
HPGD P15428 1/20 0.43
HDAC3 O15379 2/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC6 Q9UBN7 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
HTT P42858 2/20 0.41
USP2 O75604 2/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.39
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NAAA Q02083 1/20 0.38

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
SCHEMBL27488153 0.85 HPGD (0.41) LTB4R2HPGDHDAC3HDAC1HDAC2
SCHEMBL27339023 0.84 LTB4R2 (0.52) LTB4R2TSHRLMNAHSD17B10
SCHEMBL27469992 0.82 CHRNB2 (0.49) LTB4R2LMNAPKM
SCHEMBL27487794 0.77 ALDH1A1 (0.50) HDAC3HDAC1HDAC2HTTALDH1A1
SCHEMBL7550214 0.75 HDAC3 (0.44) LTB4R2HPGDHDAC3HDAC1HDAC2
SCHEMBL11090009 0.75 HPGD (0.48) HPGDHDAC3HDAC1HDAC2HTT
SCHEMBL27549223 0.75 TRPM8 (0.44) HPGDHTTTSHRALDH1A1NR1H2
SCHEMBL27475732 0.74 PTGDR2 (0.50) HDAC3HDAC1HDAC2SMN1; SMN2LMNA
SCHEMBL11172546 0.72 RAB9A (0.56) HTTUSP2TSHRALDH1A1SMN1; SMN2
SCHEMBL4004765 0.71 NAAA (0.47) HPGDHDAC3HDAC1HDAC2SMN1; SMN2

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
CN-1161331-C Hydrazine derivative - 2004-08-11 CN disclosed
CN-1265096-A Hydrazine derivatives HOFFMANN LA ROCHE (CH) 2000-08-30 CN disclosed