SCHEMBL27555697

SCHEMBL27555697

CCCCCCCCC(O)c1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 3/20 0.52
KDM4E B2RXH2 3/20 0.52
ESR1 P03372 3/20 0.52
ADORA3 P0DMS8 3/20 0.52
SLC6A2 P23975 3/20 0.52
SLC6A3 Q01959 3/20 0.52
ADRA2A P08913 2/20 0.52
TACR2 P21452 2/20 0.52
SLC6A4 P31645 2/20 0.52
ALDH1A1 P00352 2/20 0.52
LMNA P02545 2/20 0.52
CYP3A4 P08684 2/20 0.52
CHRM2 P08172 2/20 0.52
CHRM1 P11229 2/20 0.52
PTGS1 P23219 2/20 0.52
SHBG P04278 1/20 0.52
TP53 P04637 1/20 0.52
HSPD1 P10809 1/20 0.52
ADRB3 P13945 1/20 0.52
HTR2C P28335 1/20 0.52

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
SCHEMBL4860981 1.00 HIF1A (0.52) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL27981045 1.00 HIF1A (0.52) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL10457370 1.00 HIF1A (0.52) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL12087597 1.00 HIF1A (0.52) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL9121212 0.98 TAAR1 (0.52) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL22034389 0.94 HIF1A (0.47) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL22034390 0.94 HIF1A (0.47) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL4625231 0.92 TAAR1 (0.54) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL7066863 0.87 TAAR1 (0.62) HIF1AKDM4EESR1ADORA3SLC6A2
SCHEMBL8092484 0.87 ESR1 (0.46) HIF1AKDM4EESR1ADORA3SLC6A2

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
CN-113549606-A Alpha-amylase variants with altered properties 诺维信公司 2021-10-26 CN disclosed
CN-107151662-B Alpha-amylase variants with altered properties 诺维信公司 2021-06-29 CN disclosed
CN-102471244-B Process for producing N-substituted carbamate, process for producing isocyanate using the N-substituted carbamate, and composition for transporting and storing N-substituted carbamate containing N-substituted carbamate and aromatic hydroxy compound ASAHI CHEMICAL CORP 2014-09-24 CN disclosed
CN-1196334-A Method for preparing cation/amphoteric graft polyacrylamide flocculating agent GUANGZHOU CITY ENVIRONMENTAL P (CN) 1998-10-21 CN disclosed