SCHEMBL9424673

SCHEMBL9424673

C1CCC(=C2CCC(C3CCCCC3)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
NOS1 P29475 3/20 0.34
NOS2 P35228 3/20 0.34
NOS3 P29474 2/20 0.34
KMT2A Q03164 1/20 0.33
SLC18A3 Q16572 1/20 0.33

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
SCHEMBL7627654 0.79 ALDH1A1 (0.39) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL23426202 0.77 ALDH1A1 (0.39) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL15703279 0.73 TRIM24 (0.43) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL1628153 0.73 TRIM24 (0.43) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL8653747 0.73 TRIM24 (0.43) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL6797157 0.73 TRIM24 (0.43) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL365601 0.73 TRIM24 (0.43) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL11067883 0.73 TRIM24 (0.43) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL1332943 0.73 TRIM24 (0.43) ALDH1A1NOS1NOS2NOS3KMT2A
SCHEMBL502191 0.73 TRIM24 (0.43) ALDH1A1NOS1NOS2NOS3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5334712-A Estrane or androstane pyridinyl alkyl or alkylphenyl amine steroids for antidiabetes and obesity THE UPJOHN COMPANY (US) 1994-08-02 US disclosed
US-5274089-A A estra-1,3,5(10)-triene derivative THE UPJOHN COMPANY (US) 1993-12-28 US disclosed
US-5196542-A Phospholipase A2 inhibitors THE UPJOHN COMPANY (US) 1993-03-23 US disclosed
US-5187299-A Phospholipase inhibitors; treating diabetes, obesity THE UPJOHN COMPANY (US) 1993-02-16 US disclosed
US-5145874-A Phospholipase inhibitor, hypoglycemic agent, antidiabetic, obesity THE UPJOHN COMPANY (US) 1992-09-08 US disclosed
US-4917826-A TREATING DIABETES AND OBESITY THE UPJOHN COMPANY (US) 1990-04-17 US disclosed