SCHEMBL30933736

SCHEMBL30933736

CN1CCC(NCc2cc(Cl)ccc2OCC2CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.46
PTGER1 P34995 6/20 0.45
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
BACE1 P56817 1/20 0.42
EGFR P00533 2/20 0.41
POLB P06746 1/20 0.41
HTR2C P28335 3/20 0.40
HTR2B P41595 3/20 0.40
MEN1 O00255 1/20 0.40
MITF O75030 1/20 0.40
KMT2A Q03164 1/20 0.40
GRM2 Q14416 1/20 0.40
GRM3 Q14832 1/20 0.40
FGFR1 P11362 1/20 0.40
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
CCR5 P51681 1/20 0.40

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
SCHEMBL30933688 0.88 POLB (0.50) OPRL1BCHEACHEBACE1POLB
SCHEMBL30933687 0.86 MAPT (0.53) OPRL1BCHEACHEBACE1POLB
SCHEMBL30933655 0.85 HTR2C (0.41) OPRL1BCHEACHEBACE1POLB
SCHEMBL29227125 0.81 CCR5 (0.50) PTGER1HTR2CHTR2BMEN1KMT2A
SCHEMBL29227238 0.81 CCR5 (0.60) CCR5
SCHEMBL30873495 0.81 CCR5 (0.60) CCR5
SCHEMBL7666839 0.77 CCR5 (0.51) PTGER1HTR2CHTR2BMEN1KMT2A
SCHEMBL30933787 0.77 ALDH1A1 (0.48) BCHEACHEBACE1POLBMEN1
SCHEMBL30933679 0.77 NPBWR1 (0.47) POLBHTR2CHTR2BMEN1KMT2A
SCHEMBL22361728 0.77 BCHE (0.66) OPRL1BCHEACHEBACE1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024105007-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed