SCHEMBL7801022

SCHEMBL7801022

BrC1CNCCN1c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.57
SLC6A4 P31645 4/20 0.57
SLC6A3 Q01959 4/20 0.57
ADRB1 P08588 2/20 0.47
SIGMAR1 Q99720 2/20 0.47
HTR3E A5X5Y0 1/20 0.47
HTR3B O95264 1/20 0.47
HTR3A P46098 1/20 0.47
HTR3D Q70Z44 1/20 0.47
HTR3C Q8WXA8 1/20 0.47
HTR2C P28335 8/20 0.41
HTR2B P41595 7/20 0.41
HTR2A P28223 4/20 0.41
BPTF Q12830 1/20 0.39
SLC18A3 Q16572 1/20 0.39
HTR1A P08908 1/20 0.39
HTR7 P34969 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP2D6 P10635 1/20 0.38

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
Hydrochloric Acid SCHEMBL27862879 0.98 SLC6A2 (0.55) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
SCHEMBL988610 0.78 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
SCHEMBL1028438 0.78 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
SCHEMBL644788 0.78 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
SCHEMBL17884678 0.78 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
SCHEMBL2975110 0.78 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
SCHEMBL710615 0.78 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
SCHEMBL2454158 0.78 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
SCHEMBL17884836 0.78 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1
Bromide SCHEMBL10498800 0.76 SLC6A2 (0.55) SLC6A2SLC6A4SLC6A3ADRB1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118221612-A Preparation method of l- [2- (2, 4-dimethylbenzenesulfide) -phenyl ] piperazine halogen acid salt 浙江华海药业股份有限公司 2024-06-21 CN disclosed
CN-107501299-A The simultaneously carboxamides derivatives of [3,2 a] pyrimidine 2 and the application of 5,7 diphenyl 5H thiazoles 石家庄学院 2017-12-22 CN disclosed
CN-107235994-A The simultaneously acetamide derivative of [3,2 a] pyrimidine 3 and the application of 5,7 diphenyl 5H thiazoles 石家庄学院 2017-10-10 CN disclosed
EP-1075469-A1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2001-02-14 EP disclosed
WO-2000052001-A1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-09-08 WO disclosed