SCHEMBL30936641

SCHEMBL30936641

Cc1c(C(=O)N2CCCCC2)nn(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.69
CNR2 P34972 2/20 0.69
ALDH1A1 P00352 3/20 0.62
TSHR P16473 1/20 0.62
LMNA P02545 2/20 0.49
POLB P06746 2/20 0.49
USP2 O75604 1/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CREBBP Q92793 1/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP1A2 P05177 1/20 0.49
HTT P42858 1/20 0.48
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
PIK3CD O00329 1/20 0.46
PIK3R2 O00459 1/20 0.46
PIK3CA P42336 1/20 0.46

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
SCHEMBL2919759 0.89 CNR1 (0.58) CNR1CNR2ALDH1A1TSHRPOLB
SCHEMBL2915869 0.81 CYP2C9 (0.63) CNR1CNR2ALDH1A1SMN1; SMN2NPSR1
SCHEMBL2918283 0.79 ALDH1A1 (0.55) CNR1CNR2ALDH1A1POLBUSP2
SCHEMBL30936703 0.78 CNR1 (0.60) CNR1CNR2ALDH1A1LMNAHPGD
SCHEMBL30936648 0.76 CNR1 (0.67) CNR1CNR2ALDH1A1TSHRLMNA
SCHEMBL2913926 0.75 MGLL (0.50) CNR1CNR2ALDH1A1TSHRPOLB
SCHEMBL16197600 0.75 CNR1 (0.90) CNR1CNR2LMNANPSR1CYP2C9
SCHEMBL2919412 0.74 ALDH1A1 (0.73) CNR1CNR2ALDH1A1HPGDNPSR1
SCHEMBL4781711 0.73 CNR1 (0.73) CNR1CNR2LMNANPSR1CYP2C9
SCHEMBL18353073 0.73 CNR1 (0.54) CNR1CNR2ALDH1A1HPGDSMN1; SMN2

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-2024092205-A1 INHIBITION OF SHIP1 AS A THERAPEUTIC STRATEGY FOR THE TREATMENT OF ALZHEIMER'S DISEASE THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-05-02 WO disclosed