SCHEMBL23883151

SCHEMBL23883151

OCCCCCCCCCCCCCNc1ccnc2cc(Cl)ccc12

nearest known ligand 0.90

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.84
FERMT2 Q96AC1 4/20 0.74
CYP1A2 P05177 1/20 0.74
NR4A2 P43354 1/20 0.69
CDK1 P06493 1/20 0.69
HRH3 Q9Y5N1 7/20 0.65
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62

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
SCHEMBL11756506 1.00 CCR1 (0.84) CCR1FERMT2CYP1A2NR4A2CDK1
SCHEMBL11758461 1.00 CCR1 (0.84) CCR1FERMT2CYP1A2NR4A2CDK1
Hydrochloric Acid SCHEMBL11758124 0.99 CCR1 (0.82) CCR1FERMT2CYP1A2NR4A2CDK1
SCHEMBL11757988 0.99 CCR1 (0.86) CCR1FERMT2CYP1A2NR4A2CDK1
SCHEMBL2528053 0.94 CCR1 (0.83) CCR1FERMT2CYP1A2NR4A2CDK1
SCHEMBL12643220 0.93 CCR1 (0.97) CCR1FERMT2CYP1A2NR4A2HRH3
SCHEMBL15481296 0.93 CCR1 (0.97) CCR1FERMT2CYP1A2NR4A2HRH3
SCHEMBL17527057 0.93 CCR1 (0.97) CCR1FERMT2CYP1A2NR4A2HRH3
Nitric Acid SCHEMBL11755033 0.92 CCR1 (0.70) CCR1FERMT2CYP1A2NR4A2CDK1
Nitric Acid SCHEMBL11759179 0.91 CCR1 (0.69) CCR1FERMT2CYP1A2NR4A2CDK1

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
WO-2021202669-A2 NUCLEOSIDE AND NUCLEOTIDE CONJUGATE COMPOUNDS AND USES THEREOF REYOUNG CORPORATION (US) 2021-10-07 WO disclosed