SCHEMBL28381908

SCHEMBL28381908

NCCCCCCCCCC(N)c1cc[c]cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.39
HTR2A P28223 1/20 0.35
HRH1 P35367 1/20 0.35
GSR P00390 1/20 0.31
SLC7A5 Q01650 1/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA3 P07451 2/20 0.31
CA4 P22748 2/20 0.31
CA6 P23280 2/20 0.31
CA5A P35218 2/20 0.31
CA7 P43166 2/20 0.31
CA9 Q16790 2/20 0.31
CA14 Q9ULX7 2/20 0.31
CA5B Q9Y2D0 2/20 0.31
DNM1 Q05193 1/20 0.31

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
SCHEMBL16935743 0.92 HRH1 (0.42) SLC2A1HTR2AHRH1
SCHEMBL16149774 0.86 HRH1 (0.39) SLC2A1HTR2AHRH1
SCHEMBL21753852 0.83 SLC2A1 (0.38) SLC2A1
SCHEMBL27528445 0.83 SLC2A1 (0.57) SLC2A1HTR2ACA2LMNABLM
SCHEMBL8630366 0.83 SLC2A1 (0.57) SLC2A1HTR2ACA2LMNABLM
SCHEMBL28741672 0.83 SLC2A1 (0.57) SLC2A1HTR2ACA2LMNABLM
SCHEMBL27586345 0.81 SLC2A1 (0.36) SLC2A1
SCHEMBL8829324 0.80 HRH1 (0.57) SLC2A1HTR2AHRH1SLC7A5
SCHEMBL15709694 0.78 SLC2A1 (0.47) SLC2A1CA2TSHR
SCHEMBL9189348 0.78 HRH1 (0.59) HTR2AHRH1SLC7A5

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-107001436-B Adeno-associated viral vectors for the treatment of Myocilin (MYOC) glaucoma 建新公司 2023-01-06 CN disclosed
CN-111479568-A Combination of sppecprost and Rho kinase inhibitor 参天制药株式会社 2020-07-31 CN disclosed
CN-111032054-A Radiation sterilization of hyper-compressed polymeric dosage forms 持续纳米系统有限责任公司 2020-04-17 CN disclosed