SCHEMBL10373136

SCHEMBL10373136

CCC(COC)(C(=O)O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
FFAR3 O14843 1/20 0.30

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
SCHEMBL10911130 0.81 LMNA (0.36) ALDH1A1
SCHEMBL9121358 0.81 THRB (0.36) ALDH1A1THRB
SCHEMBL10371056 0.80 DGAT1 (0.34) MEN1ALDH1A1KMT2A
SCHEMBL51201 0.78 FFAR3 (0.41) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL10911658 0.78 TDP1 (0.35) MEN1ALDH1A1KMT2A
SCHEMBL221073 0.77 PTPN1 (0.40) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL11852202 0.76 CYP2D6 (0.41) ALDH1A1
SCHEMBL3673385 0.75 ALDH1A1 (0.39) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL9489101 0.75 FFAR3 (0.39) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL104624 0.75 FFAR3 (0.39) MEN1ALDH1A1CYP1A2THRBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0129773-B1 INSECTICIDAL CARBAMATES BASF Aktiengesellschaft (DE) 1990-09-12 EP disclosed
US-4537901-A MITICIDES BASF AKTIENGESELLSCHAFT (DE) 1985-08-27 US disclosed
EP-0129773-A2 Insecticidal carbamates BASF Aktiengesellschaft (DE) 1985-01-02 EP disclosed