SCHEMBL30360702

SCHEMBL30360702

NCC1OCc2c(Cl)cccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 6/20 0.57
ADRA2B P18089 6/20 0.57
ADRA2C P18825 6/20 0.57
ADRA1D P25100 6/20 0.57
ADRA1A P35348 6/20 0.57
ADRA1B P35368 6/20 0.57
HTR2C P28335 4/20 0.46
HTR2A P28223 2/20 0.46
HTR2B P41595 2/20 0.46
DRD1 P21728 8/20 0.44
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KEAP1 Q14145 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
SCHEMBL19812997 1.00 ADRA2A (0.57) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL30360710 0.83 DRD1 (0.60) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL19812914 0.83 DRD1 (0.60) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL32670712 0.83 DRD1 (0.60) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL19813088 0.83 DRD1 (0.60) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL19812912 0.83 DRD1 (0.60) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL30360712 0.83 DRD1 (0.60) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL19812847 0.81 ADRA1A (0.41) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL19821182 0.80 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL10925316 0.79 ADRA2A (0.71) ADRA2AADRA2BADRA2CADRA1DADRA1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4464317-A2 COMPOUNDS AND COMPOSITIONS AND USES THEREOF Sumitomo Pharma America, Inc. (US) 2024-11-20 EP disclosed
CN-116514761-A Compounds, compositions and uses thereof 赛诺维信制药公司 2023-08-01 CN disclosed
CN-116283877-A Compounds, compositions and uses thereof 赛诺维信制药公司 2023-06-23 CN disclosed
CN-110088107-B Compounds, compositions and uses thereof 赛诺维信制药公司 2023-04-14 CN disclosed