SCHEMBL4553164

SCHEMBL4553164

CCCCCc1ccc2cc(N)ccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.53
TLR8 Q9NR97 6/20 0.49
SKP2 Q13309 1/20 0.49
BDKRB2 P30411 1/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HSD17B10 Q99714 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ESR1 P03372 2/20 0.44
ADRA2A P08913 2/20 0.44
ADORA3 P0DMS8 2/20 0.44
TACR2 P21452 2/20 0.44
SLC6A2 P23975 2/20 0.44

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
SCHEMBL5748831 0.95 HTR2A (0.53) HTR2ATLR8SKP2KDM4EALDH1A1
SCHEMBL5745979 0.95 HTR2A (0.53) HTR2ATLR8SKP2KDM4EALDH1A1
SCHEMBL5750808 0.95 HTR2A (0.53) HTR2ATLR8SKP2KDM4EALDH1A1
SCHEMBL5747852 0.95 HTR2A (0.53) HTR2ATLR8SKP2KDM4EALDH1A1
SCHEMBL5748730 0.95 HTR2A (0.53) HTR2ATLR8SKP2KDM4EALDH1A1
SCHEMBL5749915 0.95 HTR2A (0.53) HTR2ATLR8SKP2KDM4EALDH1A1
SCHEMBL11788025 0.93 HTR2A (0.55) HTR2ATLR8SKP2KDM4EALDH1A1
SCHEMBL6563401 0.88 BDKRB2 (0.55) HTR2ATLR8BDKRB2KDM4EALDH1A1
SCHEMBL17592501 0.86 ALDH1A1 (0.46) SKP2KDM4EALDH1A1HSD17B10MEN1
SCHEMBL11690859 0.86 PTGS2 (0.57) HTR2ABDKRB2KDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022011508-A1 SYSTEMS AND METHODS FOR PRESSURE MEASUREMENT JILIN UNIVERSITY (CN) 2022-01-20 WO claimed
CN-112088295-A Pressure measurement system and method 吉林大学 2020-12-15 CN claimed
CN-112088295-B Pressure measurement system and method 吉林大学 2022-02-15 CN disclosed
CN-112088295-B Pressure measurement system and method 吉林大学 2022-02-15 CN disclosed
WO-2022011508-A1 SYSTEMS AND METHODS FOR PRESSURE MEASUREMENT JILIN UNIVERSITY (CN) 2022-01-20 WO disclosed
WO-2022011508-A1 SYSTEMS AND METHODS FOR PRESSURE MEASUREMENT JILIN UNIVERSITY (CN) 2022-01-20 WO disclosed
CN-112088295-A Pressure measurement system and method 吉林大学 2020-12-15 CN disclosed
CN-112088295-A Pressure measurement system and method 吉林大学 2020-12-15 CN disclosed
EP-2075245-B1 Two-photon probe for real-time monitoring of intracellular calcium ions, method for preparing the probe and method for real-time monitoring of intracellular calcium ions using the probe UNIV KOREA IND & ACAD COOP (KR) 2014-12-31 EP disclosed
EP-2075245-A2 Two-photon probe for real-time monitoring of intracellular calcium ions, method for preparing the probe and method for real-time monitoring of intracellular calcium ions using the probe Korea University Industry and Academy Cooperation Foundation (KR) 2009-07-01 EP disclosed