SCHEMBL29033508

SCHEMBL29033508

CN1CC=C(c2c(-c3ccccc3)[nH]c3ccccc23)CC1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.58
HTR2A P28223 3/20 0.58
HTR2C P28335 1/20 0.58
LMNA P02545 2/20 0.54
KDM4E B2RXH2 1/20 0.54
POLB P06746 1/20 0.54
HTR1A P08908 1/20 0.54
ALOX15 P16050 1/20 0.54
SLC6A4 P31645 1/20 0.54
HSD17B10 Q99714 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ESR1 P03372 3/20 0.51
ESR2 Q92731 3/20 0.51
CDK4 P11802 1/20 0.47
CCND1 P24385 1/20 0.47
MEN1 O00255 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL10533610 0.83 HTR6 (0.68) HTR6HTR2AHTR2CLMNAKDM4E
SCHEMBL8524450 0.81 LMNA (0.56) HTR6HTR2AHTR2CLMNAKDM4E
SCHEMBL16862164 0.77 QDPR (0.67) HTR6LMNAKDM4EPOLBHTR1A
SCHEMBL50923 0.77 QDPR (0.67) HTR6LMNAKDM4EPOLBHTR1A
Bromide SCHEMBL11557389 0.76 QDPR (0.65) HTR6LMNAKDM4EPOLBHTR1A
Ammonia Solution, Strong SCHEMBL15875021 0.76 QDPR (0.65) HTR6LMNAKDM4EPOLBHTR1A
Hydrochloric Acid SCHEMBL1148906 0.76 QDPR (0.65) HTR6LMNAKDM4EPOLBHTR1A
SCHEMBL29033503 0.74 HTR2A (0.63) HTR6HTR2AHTR2CKDM4EESR1
Hydrochloric Acid SCHEMBL19717522 0.74 QDPR (0.62) HTR6LMNAKDM4EPOLBHTR1A
SCHEMBL13898494 0.74 QDPR (0.68) HTR6LMNAKDM4EPOLBHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116178243-B Preparation method and application of (hetero) aryl fused carbazole compound 西南医科大学 2024-11-22 CN disclosed
CN-116178243-A Preparation method and application of (hetero) aryl fused carbazole compound 西南医科大学 2023-05-30 CN disclosed