SCHEMBL28007148

SCHEMBL28007148

CCC(N)CNCC(C)C

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.45
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 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
SCHEMBL1275649 0.89 ALDH1A1 (0.36) ANPEPALDH1A1CYP3A4TSHR
SCHEMBL27732079 0.84 ALDH1A1 (0.32) ANPEPALDH1A1CYP3A4TSHR
SCHEMBL1741257 0.80 TSHR (0.41) ANPEPALDH1A1TSHR
Isopropylamine SCHEMBL11213324 0.80 ANPEP (0.54) ANPEPADH1BADH1CADH1AALDH1A1
SCHEMBL6926413 0.78
SCHEMBL21900270 0.78
SCHEMBL26779891 0.77 ALDH1A1 (0.30) ALDH1A1CYP3A4TSHR
SCHEMBL17336278 0.77 ALDH1A1 (0.45) ANPEPALDH1A1CYP3A4TSHR
SCHEMBL64203 0.76
SCHEMBL20757778 0.75 ANPEP (0.42) ANPEPADH1BADH1CADH1AALDH1A1

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
CN-103080844-B Rinse liquid for lithography and method for forming pattern using same MERCK PATENT GMBH 2015-05-13 CN claimed
CN-103080844-B Rinse liquid for lithography and method for forming pattern using same MERCK PATENT GMBH 2015-05-13 CN disclosed