SCHEMBL6159366

SCHEMBL6159366

CC1NCCc2cc(Cl)ccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.61
HTR2C P28335 5/20 0.61
HTR2B P41595 5/20 0.61
MAOA P21397 8/20 0.54
DRD2 P14416 2/20 0.54
TSHR P16473 2/20 0.54
HSD17B10 Q99714 2/20 0.54
KDM4E B2RXH2 1/20 0.54
CYP2C9 P11712 1/20 0.54
DRD3 P35462 1/20 0.54
HIF1A Q16665 1/20 0.54
DRD4 P21917 1/20 0.54
ADRB1 P08588 1/20 0.50
HTR1A P08908 1/20 0.50
ADRA2A P08913 1/20 0.50
ADRA2B P18089 1/20 0.50
ADRA2C P18825 1/20 0.50
CNR1 P21554 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50

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
SCHEMBL31579647 1.00 HTR2A (0.61) HTR2AHTR2CHTR2BMAOADRD2
SCHEMBL1010489 0.86 HTR2A (0.63) HTR2AHTR2CHTR2BMAOADRD2
SCHEMBL21959060 0.82 MAOA (0.64) MAOADRD2TSHRHSD17B10KDM4E
Bromide SCHEMBL30645357 0.81 MAOA (0.65) MAOADRD2TSHRHSD17B10KDM4E
Bromide SCHEMBL21858250 0.81 MAOA (0.65) MAOADRD2TSHRHSD17B10KDM4E
Bromide SCHEMBL31505378 0.81 MAOA (0.65) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL7820935 0.80 MAOA (0.56) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL22680298 0.79 MAOA (0.54) HTR2AHTR2CMAOADRD2TSHR
SCHEMBL22680299 0.79 MAOA (0.54) HTR2AHTR2CMAOADRD2TSHR
SCHEMBL1010996 0.79 MAOA (0.54) HTR2AHTR2CHTR2BMAOADRD2

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
EP-4678644-A1 SUBSTITUTED DIHYDROTHIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Shanghai Yidi Biotechnology Co., Ltd. (CN) 2026-01-14 EP disclosed
WO-2024213089-A1 SUBSTITUTED DIHYDROTHIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海壹迪生物技术有限公司 2024-10-17 WO disclosed
EP-1131312-B1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP LTD (KR) 2005-10-26 EP disclosed
EP-1131312-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION, LTD. (KR) 2001-09-12 EP disclosed
WO-2000029403-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2000-05-25 WO disclosed