SCHEMBL9621591

SCHEMBL9621591

CCCCCCCCCCCCCCCC(=O)N(CCS(=O)(=O)O)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.41
LTB4R2 Q9NPC1 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX1 P07099 8/20 0.37
EPHX2 P34913 2/20 0.37
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35

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
Ammonia Solution, Strong SCHEMBL28868877 0.99 NAAA (0.40) NAAALTB4R2THRATHRBL3MBTL1
SCHEMBL31194679 0.99 NAAA (0.40) NAAALTB4R2THRATHRBL3MBTL1
SCHEMBL11323065 0.87 NAAA (0.40) NAAALTB4R2THRATHRBL3MBTL1
SCHEMBL27622614 0.86 NAAA (0.47) NAAALTB4R2THRATHRBL3MBTL1
Iodine SCHEMBL5934010 0.85 NAAA (0.38) NAAALTB4R2THRATHRBL3MBTL1
SCHEMBL3401645 0.79 DNM1 (0.44) NAAALTB4R2THRATHRBL3MBTL1
SCHEMBL11458712 0.77 DRD2 (0.41) NAAATHRATHRBEPHX1EPHX2
SCHEMBL22023395 0.76 NAAA (0.46) NAAATHRATHRBEPHX1EPHX2
Ammonia Solution, Strong SCHEMBL28049353 0.76 DRD2 (0.40) NAAATHRATHRBEPHX1EPHX2
SCHEMBL21867295 0.75 PYGL (0.40) L3MBTL1ALDH1A1

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-0186436-B1 LIQUID CLEANSING COMPOSITION WARNER-LAMBERT COMPANY (US) 1992-03-18 EP claimed
US-4007083-A Method for forming wet-laid non-woven webs INTERNATIONAL PAPER COMPANY (US) 1977-02-08 US claimed
US-4007083-A Method for forming wet-laid non-woven webs INTERNATIONAL PAPER COMPANY (US) 1977-02-08 US disclosed