SCHEMBL10952012

SCHEMBL10952012

CCCCCCCCCCCCCCCCCCOC(CC)NCCCN

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.46
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
EPHX1 P07099 1/20 0.40
TLR2 O60603 5/20 0.38
HTT P42858 1/20 0.35
CYP3A4 P08684 1/20 0.34

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
SCHEMBL8992553 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL10908778 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL9013910 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL10908837 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL8992533 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL9013892 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL8992562 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL10951735 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL8992572 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL28449560 0.93 DNM1 (0.36) DNM1MEN1KMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4508541-A DETERGENTS TEXACO INC. (US) 1985-04-02 US disclosed