SCHEMBL9813664

SCHEMBL9813664

O=C(O)C=C1CCCCC1CO

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CAMK2A Q9UQM7 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CDC25A P30304 1/20 0.35
CDC25B P30305 1/20 0.35
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
OPRK1 P41145 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL10537802 0.94 CAMK2A (0.38) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL15058973 0.81 NOS1 (0.39) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL15058972 0.81 NOS1 (0.39) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL9790817 0.77 CAMK2A (0.44) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL9790676 0.77 CAMK2A (0.44) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL9790853 0.77 CAMK2A (0.44) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL9790681 0.77 CAMK2A (0.44) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL9790856 0.77 CAMK2A (0.44) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL9790818 0.77 CAMK2A (0.44) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL15058260 0.75 NOS1 (0.37) CAMK2ACYP1A2CYP2D6CYP2C9CYP2C19

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240224994-A1 INSECT REPELLANT FORMULATION AND METHOD OF USING SAME UNITED INDUSTRIES CORPORATION 2024-07-11 US disclosed
WO-2022251534-A1 INSECT REPELLENT FORMULATION AND METHOD OF USING SAME UNITED INDUSTRIES CORPORATION (US) 2022-12-01 WO disclosed
EP-0219199-B1 METHOD FOR PREPARATION OF LACTONES COULSTON INTERNATIONAL CORPORATION (US) 1991-07-31 EP disclosed
US-4772728-A AND ALDEHYDE ANGUS CHEMICAL COMPANY (US) 1988-09-20 US disclosed
EP-0219199-A1 Method for preparation of lactones COULSTON INTERNATIONAL CORPORATION (US) 1987-04-22 EP disclosed