SCHEMBL1727720

SCHEMBL1727720

C=CCC(N)(CC=C)COCC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL23686406 0.73 THRB (0.39)
SCHEMBL830878 0.72
SCHEMBL1726935 0.72 TSHR (0.32)
SCHEMBL2326072 0.71
SCHEMBL361077 0.71 ALDH1A1 (0.38)
Hydrochloric Acid SCHEMBL1326222 0.70 TSHR (0.30)
SCHEMBL11429120 0.69 TSHR (0.35)
SCHEMBL2787839 0.69 TSHR (0.35)
SCHEMBL10649149 0.69 KDM4E (0.45)
Hydrochloric Acid SCHEMBL142823 0.68 ALDH1A1 (0.35)

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
US-9469713-B2 Ampholytic ter-polymers for use in personal care compositions BASF SE (DE) 2016-10-18 US disclosed
EP-2403472-B1 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS BASF SE (DE) 2014-08-20 EP disclosed
US-20140147399-A1 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS BASF SE (DE) 2014-05-29 US disclosed
US-8663612-B2 Ampholytic ter-polymers for use in personal care compositions BASF SE (DE) 2014-03-04 US disclosed
EP-2403472-A2 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS BASF SE (DE) 2012-01-11 EP disclosed
WO-2010101742-A2 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS CIBA CORPORATION (US) 2010-09-10 WO disclosed
US-20100226868-A1 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS BASF SE (DE) 2010-09-09 US disclosed