SCHEMBL8456972

SCHEMBL8456972

[CH2]SCCCCCCCCCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.53
THRB P10828 2/20 0.53
HSD17B10 Q99714 2/20 0.42
CES2 O00748 1/20 0.42
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
GMNN O75496 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
BLM P54132 1/20 0.42
DNM1 Q05193 7/20 0.41
CA2 P00918 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC22A1 O15245 1/20 0.40

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
SCHEMBL5435445 1.00 TSHR (0.53) TSHRTHRBHSD17B10CES2CTSL
SCHEMBL916768 1.00 TSHR (0.53) TSHRTHRBHSD17B10CES2CTSL
SCHEMBL291820 1.00 TSHR (0.53) TSHRTHRBHSD17B10CES2CTSL
SCHEMBL6731455 1.00 TSHR (0.53) TSHRTHRBHSD17B10CES2CTSL
SCHEMBL291000 1.00 TSHR (0.53) TSHRTHRBHSD17B10CES2CTSL
SCHEMBL291923 1.00 TSHR (0.53) TSHRTHRBHSD17B10CES2CTSL
SCHEMBL9149670 1.00 TSHR (0.53) TSHRTHRBHSD17B10CES2CTSL
SCHEMBL290508 1.00
SCHEMBL290726 1.00
SCHEMBL292580 0.97

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
CN-110462502-B Method for manufacturing liquid crystal element JSR株式会社 2022-05-17 CN disclosed
CN-111718728-A Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal element JSR株式会社 2020-09-29 CN disclosed
EP-0691327-B1 AMINE DERIVATIVE AND DERMATOLOGIC PREPARATION CONTAINING THE SAME KAO CORP (JP) 1999-07-21 EP disclosed
US-5723497-A AMINE ALCOHOL DERIVATIVES FOR WRINKLE RESISTNCE KAO CORPORATION (JP) 1998-03-03 US disclosed
EP-0691327-A1 AMINE DERIVATIVE AND DERMATOLOGIC PREPARATION CONTAINING THE SAME Kao Corporation (JP) 1996-01-10 EP disclosed