SCHEMBL22338145

SCHEMBL22338145

C=CN(CCN)CCCC

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.35
TSHR P16473 3/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
EPHX1 P07099 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
SCHEMBL153655 0.88 TSHR (0.41) DNM1TSHRALDH1A1
Hydrochloric Acid SCHEMBL22575367 0.85 TSHR (0.39) DNM1TSHRALDH1A1
SCHEMBL22157526 0.83 DNM1 (0.42) DNM1TSHRALDH1A1EPHX1
SCHEMBL22157366 0.83 TSHR (0.38) DNM1TSHRALDH1A1
SCHEMBL22157409 0.81 DNM1 (0.46) DNM1TSHRALDH1A1EPHX1
SCHEMBL22157417 0.80 DNM1 (0.43) DNM1TSHRALDH1A1EPHX1
Hydrochloric Acid SCHEMBL22575256 0.78 DNM1 (0.46) DNM1TSHRALDH1A1EPHX1
SCHEMBL22157391 0.78 DNM1 (0.48) DNM1TSHRALDH1A1EPHX1
SCHEMBL10721827 0.78 DNM1 (0.48) DNM1TSHRALDH1A1EPHX1
SCHEMBL5819140 0.78

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
WO-2020163464-A1 CURABLE COMPOSITIONS, PRODUCTS AND ARTICLES FORMED THEREFROM, AND METHODS OF FORMING THE SAME COVESTRO LLC (US) 2020-08-13 WO disclosed