Arundic Acid

Arundic Acid

SCHEMBL5010029

CC(C)C(=Cc1ccccc1)C(=O)O.CCCCCCC(CCC)C(=O)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
LMNA P02545 1/20 0.44
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
CHRM1 P11229 1/20 0.40
AKR1A1 P14550 1/20 0.40
CHRM3 P20309 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
ADRA1A P35348 1/20 0.40
HRH1 P35367 1/20 0.40
DRD3 P35462 1/20 0.40
SLC6A3 Q01959 1/20 0.40
GRIK1 P39086 3/20 0.40
GRIK2 Q13002 3/20 0.40
ALDH1A1 P00352 2/20 0.39
HDAC8 Q9BY41 4/20 0.39
HDAC3 O15379 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
MMP2 P08253 1/20 0.39

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
SCHEMBL7266955 0.85 TDP1 (0.54) TDP1LMNAHDAC1HDAC2ALDH1A1
SCHEMBL689448 0.78 AKR1C3 (0.55) TDP1LMNAALDH1A1MEN1KMT2A
SCHEMBL22634102 0.78 AKR1C3 (0.55) TDP1LMNAALDH1A1MEN1KMT2A
SCHEMBL24370892 0.76 TSHR (0.46) TDP1LMNAHDAC1HDAC2ALDH1A1
SCHEMBL83536 0.75 TDP1 (0.49) TDP1LMNAHDAC2ALDH1A1EGFR
SCHEMBL432094 0.74 CHRM1 (0.73) TDP1HDAC1HDAC2CHRM1AKR1A1
SCHEMBL1115939 0.74 CHRM1 (0.73) TDP1HDAC1HDAC2CHRM1AKR1A1
Arundic Acid SCHEMBL277260 0.74 CHRM1 (0.73) TDP1HDAC1HDAC2CHRM1AKR1A1
SCHEMBL2489255 0.74 CHRM1 (0.73) TDP1HDAC1HDAC2CHRM1AKR1A1
SCHEMBL1115797 0.74 CHRM1 (0.73) TDP1HDAC1HDAC2CHRM1AKR1A1

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
EP-1922398-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-05-21 EP disclosed
WO-2007028477-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed