SCHEMBL30701934

SCHEMBL30701934

Clc1ccccc1COc1cncc(-n2ccc(C3CCNCC3)n2)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 3/20 0.44
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
MAP4K3 Q8IVH8 1/20 0.41
SRC P12931 2/20 0.39
HTR6 P50406 1/20 0.39
MCHR1 Q99705 1/20 0.38
PRMT5 O14744 1/20 0.38
USP1 O94782 3/20 0.38
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
SPHK2 Q9NRA0 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36

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
SCHEMBL30701913 0.82 INPPL1 (0.48) INPPL1SLC6A2SLC6A4SLC6A3MAP4K3
SCHEMBL30701936 0.76 INPPL1 (0.58) INPPL1MAP4K3SRC
SCHEMBL30701925 0.71 INPPL1 (0.82) INPPL1MAP4K3
Hydrochloric Acid SCHEMBL30701912 0.70 INPPL1 (0.81) INPPL1MAP4K3
SCHEMBL23411539 0.69 HTR6 (0.47) SLC6A2SLC6A4SLC6A3HTR6USP1
SCHEMBL29892599 0.69 HTR6 (0.47) SLC6A2SLC6A4SLC6A3HTR6USP1
SCHEMBL23410958 0.68 HTR3A (0.42) USP1
SCHEMBL23411312 0.65 HTR2C (0.50) HTR6USP1HTR2C
SCHEMBL29891790 0.65 HTR2C (0.50) HTR6USP1HTR2C
Hydrochloric Acid SCHEMBL16827834 0.64 NPC1 (0.38) USP1

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
EP-4554936-A1 CRIZOTINIB ANALOGUES AS SHIP1 INHIBITORS USEFUL TO TREAT ALZHEINER'S DISEASES The Trustees of Indiana University (US) 2025-05-21 EP disclosed
WO-2024015759-A1 CRIZOTINIB ANALOGUES AS SHIP1 INHIBITORS USEFUL TO TREAT ALZHEINER'S DISEASES THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-01-18 WO disclosed