SCHEMBL14798145

SCHEMBL14798145

C=C(COCCCCCCCC)c1ccco1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
GAA P10253 2/20 0.41
POLB P06746 2/20 0.40
HDAC3 O15379 1/20 0.40
CES2 O00748 2/20 0.40
RAB9A P51151 1/20 0.38
DNMT1 P26358 1/20 0.38
CCNB2 O95067 1/20 0.37
CCNE2 O96020 1/20 0.37
CDK1 P06493 1/20 0.37
CCNB1 P14635 1/20 0.37
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
CCNB3 Q8WWL7 1/20 0.37
LMNA P02545 2/20 0.37

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
SCHEMBL14798139 0.94 KMT2A (0.47) TSHRMAPTALDH1A1NPSR1KMT2A
SCHEMBL14797981 0.88 KMT2A (0.43) TSHRMAPTALDH1A1NPSR1KMT2A
SCHEMBL14797763 0.81 NPC1 (0.40) TSHRMAPTALDH1A1KMT2AGAA
SCHEMBL28660261 0.81 CES2 (0.45) TSHRMAPTALDH1A1KMT2AMEN1
SCHEMBL16753028 0.80 GAA (0.52) TSHRMAPTALDH1A1NPSR1KMT2A
SCHEMBL136809 0.79 KMT2A (0.53) TSHRMAPTALDH1A1NPSR1KMT2A
SCHEMBL21596569 0.75 CES2 (0.44) TSHRALDH1A1CES2LMNAPLA2G4B
SCHEMBL21596565 0.75 CES2 (0.44) TSHRALDH1A1CES2LMNAPLA2G4B
SCHEMBL7061572 0.75 CES2 (0.44) TSHRALDH1A1CES2LMNAPLA2G4B
SCHEMBL8945483 0.75 CES2 (0.44) TSHRALDH1A1CES2LMNAPLA2G4B

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
US-8722295-B2 Toner for electrostatic image development and production process thereof KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2014-05-13 US disclosed
US-20130078566-A1 TONER FOR ELECTROSTATIC IMAGE DEVELOPMENT AND PRODUCTION PROCESS THEREOF KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-03-28 US disclosed