SCHEMBL30014770

SCHEMBL30014770

C(COC1CCNCC1)CC1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.38
SLC6A4 P31645 3/20 0.37
TPSAB1 Q15661 2/20 0.37
TPSD1 Q9BZJ3 2/20 0.37
TPSG1 Q9NRR2 2/20 0.37
ITGB3 P05106 5/20 0.36
ITGA2B P08514 5/20 0.36
GNAO1 P09471 1/20 0.34
SLC6A2 P23975 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
HTR3A P46098 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HTR4 Q13639 1/20 0.33
AVPR2 P30518 1/20 0.33
AVPR1A P37288 1/20 0.33
FAAH O00519 1/20 0.33
NAMPT P43490 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
SCHEMBL29892104 0.81 TPSAB1 (0.38) HRH3SLC6A4TPSAB1TPSD1TPSG1
SCHEMBL27137149 0.79 ITGB3 (0.50) TPSAB1TPSD1TPSG1ITGB3ITGA2B
SCHEMBL3362157 0.78 NPC1 (0.42) HRH3SLC6A4TPSAB1TPSD1TPSG1
SCHEMBL10400656 0.77 HRH3 (0.39) HRH3SLC6A4TPSAB1TPSD1TPSG1
SCHEMBL1308005 0.77 GNAO1 (0.39) HRH3SLC6A4TPSAB1TPSD1TPSG1
SCHEMBL3020121 0.77 CHRM1 (0.43) SLC6A4GNAO1SLC6A2HTR2AHTR2C
SCHEMBL2747396 0.77 SLC6A2 (0.34) SLC6A4SLC6A2HTR2AHTR2CHTR7
SCHEMBL2747395 0.77 SLC6A2 (0.34) SLC6A4SLC6A2HTR2AHTR2CHTR7
SCHEMBL237382 0.77 ITGB3 (0.47) HRH3SLC6A4TPSAB1TPSD1TPSG1
SCHEMBL331124 0.77 HRH3 (0.47) HRH3SLC6A4TPSAB1TPSD1TPSG1

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
WO-2022223034-A1 SOS1 DEGRADATION AGENT AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海领泰生物医药科技有限公司 2022-10-27 WO disclosed
WO-2022223033-A1 SOS1 DEGRADING AGENT AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海领泰生物医药科技有限公司 2022-10-27 WO disclosed
WO-2022223039-A1 SOS1 DEGRADER, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海领泰生物医药科技有限公司 2022-10-27 WO disclosed