SCHEMBL25220133

SCHEMBL25220133

CCC(O)N(C1CCCCC1)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.42
SHBG P04278 1/20 0.39
ADH1A P07327 5/20 0.38
ADH1C P00326 4/20 0.38
ADH1B P00325 1/20 0.33
FAAH O00519 1/20 0.33
PHGDH O43175 1/20 0.33
MGLL Q99685 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
TP53 P04637 1/20 0.32

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
SCHEMBL1548849 0.84 SHBG (0.41) FDPSSHBGADH1AADH1CADH1B
SCHEMBL23736378 0.81 ADH1A (0.39) FDPSSHBGADH1AADH1CADH1B
SCHEMBL22162275 0.80 SHBG (0.38) FDPSSHBGADH1AADH1CADH1B
SCHEMBL30504869 0.77 SHBG (0.34) SHBGADH1AADH1CFAAHPHGDH
SCHEMBL20988082 0.76 SHBG (0.42) FDPSSHBGADH1AADH1CADH1B
SCHEMBL2481387 0.74 SHBG (0.41) FDPSSHBGADH1AADH1CADH1B
SCHEMBL16055688 0.74 ALDH1A1 (0.37) ADH1AADH1CMEN1ALDH1A1POLB
SCHEMBL28333138 0.74 ALDH1A1 (0.37) ADH1AADH1CMEN1ALDH1A1POLB
SCHEMBL28324607 0.74 ALDH1A1 (0.37) ADH1AADH1CMEN1ALDH1A1POLB
SCHEMBL6333593 0.73 FDPS (0.46) FDPSADH1AADH1CADH1BFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118355096-A Water-soluble metal processing oil 出光兴产株式会社 2024-07-16 CN disclosed
US-20230357663-A1 WATER-SOLUBLE METALWORKING FLUID IDEMITSU KOSAN CO.,LTD. (JP) 2023-11-09 US disclosed
US-20230348810-A1 WATER-SOLUBLE METALWORKING FLUID IDEMITSU KOSAN CO.,LTD. (JP) 2023-11-02 US disclosed
WO-2023162707-A1 WATER-SOLUBLE LUBRICANT 出光興産株式会社 2023-08-31 WO disclosed
WO-2023106341-A1 WATER-SOLUBLE METALWORKING FLUID 出光興産株式会社 2023-06-15 WO disclosed
CN-115989312-A Water-soluble metal working oil 出光兴产株式会社 2023-04-18 CN disclosed
CN-115803418-A Water-soluble metal working oil 出光兴产株式会社 2023-03-14 CN disclosed