Glutaral

Glutaral

SCHEMBL9719285

Clc1ccc(CCCI)cc1.O=CCCCC=O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.43
ALOX15 P16050 1/20 0.43
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
LMNA P02545 1/20 0.40
TAAR1 Q96RJ0 2/20 0.39
BCL2L1 Q07817 1/20 0.38
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
HTR3A P46098 1/20 0.37
HTR3D Q70Z44 1/20 0.37

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
SCHEMBL3245743 0.87 TAAR1 (0.46) IGF1RALOX15HDAC3HDAC4HDAC1
SCHEMBL5543511 0.85 HDAC3 (0.49) IGF1RALOX15HDAC3HDAC4HDAC1
SCHEMBL386164 0.84 TAAR1 (0.52) IGF1RALOX15HDAC3HDAC4HDAC1
SCHEMBL5547783 0.83 HDAC3 (0.47) IGF1RALOX15HDAC3HDAC4HDAC1
SCHEMBL9127398 0.78 IGF1R (0.53) IGF1RALOX15HDAC3HDAC4HDAC1
SCHEMBL896217 0.78 TAAR1 (0.50) IGF1RALOX15HDAC3HDAC4HDAC1
SCHEMBL11400125 0.77 IGF1R (0.52) IGF1RALOX15HDAC3HDAC4HDAC1
SCHEMBL6067810 0.77 IGF1R (0.52) IGF1RALOX15HDAC3HDAC4HDAC1
SCHEMBL2094552 0.76 KCNH2 (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2657239 0.73 TAAR1 (0.59) IGF1RALOX15LMNATAAR1HTR3E

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-0492811-A1 Antimicrobial composition and use ZENECA LIMITED (GB) 1992-07-01 EP disclosed