SCHEMBL29102010

SCHEMBL29102010

CC=CC(=O)c1cnccn1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
NAPRT Q6XQN6 1/20 0.53
HCAR2 Q8TDS4 1/20 0.53
ADORA3 P0DMS8 1/20 0.52
TSHR P16473 1/20 0.52
MC4R P32245 1/20 0.52
ADRA1A P35348 1/20 0.52
MC3R P41968 1/20 0.52
BAZ2B Q9UIF8 1/20 0.47
P4HB P07237 1/20 0.47
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MAPT P10636 1/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL9370341 0.81 KDM4E (0.50) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL4262480 0.80 HTT (0.53) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL212317 0.80 HTT (0.53) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL25894870 0.78 BAZ2B (0.48) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL6683798 0.78 KDM4E (0.59) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL28281693 0.76 KDM4E (0.57) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL28491374 0.76 KDM4E (0.57) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL7702024 0.75 KDM4E (0.50) KDM4ENAPRTHCAR2ADORA3TSHR
Water SCHEMBL10500957 0.74 KDM4E (0.55) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL11717535 0.74 KDM4E (0.50) KDM4ENAPRTHCAR2ADORA3TSHR

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
CN-115926768-B Oil-soluble viscosity reducer composition and preparation method and application thereof 中国石油化工股份有限公司 2023-11-10 CN disclosed