SCHEMBL18508052

SCHEMBL18508052

CCCCC(CN(CC)CC)OC(C)C

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.42
PLA2G2A P14555 1/20 0.42
ALDH1A1 P00352 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
DNM1 Q05193 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
SCHEMBL18508057 0.86 PLA2G1B (0.39) PLA2G1BPLA2G2AALDH1A1TDP1CYP3A4
SCHEMBL18508054 0.86 PLA2G1B (0.41) PLA2G1BPLA2G2AALDH1A1TDP1CYP3A4
SCHEMBL18508049 0.81 DNM1 (0.31) TSHRDNM1
SCHEMBL18508042 0.80 PLA2G1B (0.33) PLA2G1BPLA2G2A
SCHEMBL28122403 0.79 PLA2G1B (0.42) PLA2G1BPLA2G2AALDH1A1TDP1CYP3A4
SCHEMBL17489298 0.76 PLA2G1B (0.40) PLA2G1BPLA2G2A
SCHEMBL19103233 0.75 PLA2G1B (0.31) PLA2G1BPLA2G2A
SCHEMBL14747631 0.75 DNM1 (0.36) ALDH1A1TDP1CYP3A4TSHRL3MBTL1
Hexane SCHEMBL10548790 0.75 PLA2G1B (0.40) PLA2G1BPLA2G2ATSHRDNM1
SCHEMBL28024615 0.75 ALDH1A1 (0.37) ALDH1A1TDP1CYP3A4TSHRL3MBTL1

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
US-9994593-B2 Copper compound, starting material for forming thin film, and method for manufacturing thin film ADEKA CORPORATION (JP) 2018-06-12 US disclosed
US-20170044188-A1 COPPER COMPOUND, STARTING MATERIAL FOR FORMING THIN FILM, AND METHOD FOR MANUFACTURING THIN FILM ADEKA CORPORATION (JP) 2017-02-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170044188-A1 COPPER COMPOUND, STARTING MATERIAL FOR FORMING THIN FILM, AND METHOD FOR MANUFACTURING THIN FILM C5, C9, C1R PLA2G1B 4075/4885PLA2G2A 3208/4885ALDH1A1 513/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.