SCHEMBL23655258

SCHEMBL23655258

C=C(C)CCCCCCCCC#N

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
CYP1A2 P05177 1/20 0.38
TDP1 Q9NUW8 2/20 0.33
GBA1 P04062 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL1004740 1.00 TSHR (0.40) TSHRCYP1A2TDP1GBA1ALDH1A1
SCHEMBL1004124 0.90
SCHEMBL59578 0.80 TSHR (0.38) TSHRCYP1A2TDP1GBA1ALDH1A1
SCHEMBL59421 0.80 TSHR (0.38) TSHRCYP1A2TDP1GBA1ALDH1A1
SCHEMBL11292024 0.80 TSHR (0.38) TSHRCYP1A2TDP1GBA1ALDH1A1
SCHEMBL59073 0.80 TSHR (0.38) TSHRCYP1A2TDP1GBA1ALDH1A1
SCHEMBL60456 0.80 TSHR (0.38) TSHRCYP1A2TDP1GBA1ALDH1A1
SCHEMBL10458961 0.79
SCHEMBL8466765 0.79 TDP1 (0.41) TSHRTDP1ALDH1A1
SCHEMBL4797472 0.79 TDP1 (0.41) TSHRTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3674338-B1 STRETCHABLE WIRING FILM AND METHOD FOR FORMING THE SAME SHINETSU CHEMICAL CO (JP) 2021-09-29 EP disclosed
EP-3464489-B1 IMPROVED AQUEOUS PIGMENT DISPERSIONS LANDA LABS 2012 LTD (IL) 2021-07-21 EP disclosed