SCHEMBL22201665

SCHEMBL22201665

CCC1CCC1CCOCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.45
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE4D Q08499 1/20 0.39
POLB P06746 1/20 0.39
LTA4H P09960 1/20 0.39
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
NAAA Q02083 1/20 0.37
AGXT P21549 1/20 0.37
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
GBA1 P04062 2/20 0.36
UGCG Q16739 2/20 0.36
GBA2 Q9HCG7 2/20 0.36
EPHX2 P34913 1/20 0.36

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
SCHEMBL22201699 0.83 TSHR (0.41) TSHRTDP1L3MBTL1MEN1KMT2A
SCHEMBL20185586 0.78 MEN1 (0.42) TSHRTDP1L3MBTL1MEN1KMT2A
SCHEMBL25062343 0.78 GBA1 (0.46) TSHRMEN1KMT2APDE4DHTT
SCHEMBL12982403 0.77 TSHR (0.54) TSHRTDP1L3MBTL1MEN1KMT2A
SCHEMBL13747479 0.77 HTR2C (0.46) TSHRPDE4DLTA4HNAAAAGXT
SCHEMBL23533377 0.75 ALOX5 (0.43) TSHRTDP1L3MBTL1PDE4DHRH3
SCHEMBL28949979 0.75 ALOX5 (0.43) TSHRTDP1L3MBTL1PDE4DHRH3
SCHEMBL6138270 0.74 TSHR (0.42) TSHRTDP1L3MBTL1MEN1KMT2A
SCHEMBL6647671 0.74 TSHR (0.50) TSHRTDP1L3MBTL1MEN1KMT2A
SCHEMBL18950906 0.74 TSHR (0.50) TSHRMEN1KMT2APDE4DLTA4H

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-20200216670-A1 THERMOSETTING SILICON-CONTAINING COMPOUND, COMPOSITION FOR FORMING A SILICON-CONTAINING FILM, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-07-09 US disclosed