SCHEMBL5215315

SCHEMBL5215315

c1ccc2c(c1)cnn2N1CCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.41
CYP1A2 P05177 1/20 0.38
ADRA2A P08913 2/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
KMO O15229 1/20 0.37
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
POLB P06746 3/20 0.35
P2RX7 Q99572 1/20 0.35
LRRK2 Q5S007 1/20 0.35
HSD17B10 Q99714 3/20 0.34
TSHR P16473 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TFPI2 P48307 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GAA P10253 2/20 0.33
SLC22A12 Q96S37 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL10500232 0.96 RECQL (0.41) RECQLCYP1A2ADRA2AADRA2BADRA2C
SCHEMBL29521056 0.96 RECQL (0.41) RECQLCYP1A2ADRA2AADRA2BADRA2C
SCHEMBL9833133 0.94 RECQL (0.40) RECQLCYP1A2ADRA2AADRA2BADRA2C
SCHEMBL29521086 0.84 HTR2C (0.41) RECQLCYP1A2ADRA2AADRA2BADRA2C
SCHEMBL29520731 0.84 RECQL (0.38) RECQLCYP1A2ADRA2AADRA2BADRA2C
SCHEMBL29520805 0.84 LRRK2 (0.47) RECQLPOLBLRRK2TSHRNPSR1
SCHEMBL8470553 0.84 HTR2C (0.41) RECQLCYP1A2ADRA2AADRA2BADRA2C
Hydrochloric Acid SCHEMBL10583863 0.82 ADRA2A (0.41) RECQLCYP1A2ADRA2AADRA2BADRA2C
SCHEMBL31190755 0.77 RECQL (0.38) RECQLCYP1A2ADRA2AADRA2BADRA2C
SCHEMBL4788217 0.73 ADRA2A (0.38) RECQLCYP1A2ADRA2AADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116262739-A Nitrogen-containing aryl derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-06-16 CN disclosed
EP-1753763-A2 INDAZOLE AND INDOLONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS Pfizer Limited (GB) 2007-02-21 EP disclosed
WO-2005116027-A2 INDAZOLE AND INDOLONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS PFIZER LIMTED (GB) 2005-12-08 WO disclosed