SCHEMBL8977050

SCHEMBL8977050

CCC=C1C=C(C=Cc2ccc(N(CCO)CCO)cc2)CC(C)(C)C1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARG P37231 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
SCHEMBL21708185 0.88 MEN1 (0.33) MEN1ALDH1A1KMT2A
SCHEMBL12521242 0.83 KMT2A (0.50) MEN1ALDH1A1KMT2APPARG
SCHEMBL21678294 0.83 KMT2A (0.50) MEN1ALDH1A1KMT2APPARG
SCHEMBL14328150 0.79 CHRM2 (0.31)
SCHEMBL14329685 0.74 ALDH1A1 (0.36) MEN1ALDH1A1KMT2A
SCHEMBL14328142 0.74 ALDH1A1 (0.38) MEN1ALDH1A1KMT2A
SCHEMBL14320257 0.74 ALDH1A1 (0.44) MEN1ALDH1A1KMT2A
SCHEMBL14320256 0.74 ALDH1A1 (0.44) MEN1ALDH1A1KMT2A
SCHEMBL12482005 0.73 ALDH1A1 (0.37) MEN1ALDH1A1KMT2A
SCHEMBL8977022 0.73 MEN1 (0.31) MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5588083-A Non-linear optically active polycarbonate AKZO NOBEL N.V. (NL) 1996-12-24 US disclosed
EP-0475903-B1 Acid labile solution inhibitors and positively and negatively working radiation sensitive composition based on them OCG MICROELECTRONIC MATERIALS (US) 1996-04-24 EP disclosed
WO-1996003674-A1 BLEACHABLE OPTICAL WAVEGUIDE COMPONENT AKZO NOBEL N.V. (NL) 1996-02-08 WO disclosed
EP-0645413-A1 Non-linear optically active polycarbonate Akzo Nobel N.V. (NL) 1995-03-29 EP disclosed
EP-0475903-A1 Acid labile solution inhibitors and positively and negatively working radiation sensitive composition based on them OCG Microelectronic Materials Inc. (US) 1992-03-18 EP disclosed