SCHEMBL25019698

SCHEMBL25019698

CC1CCC(OP(=O)(O)O)CC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
INPP5A Q14642 3/20 0.52
SMPD1 P17405 1/20 0.37
ITPR3 Q14573 7/20 0.36
ITPR2 Q14571 3/20 0.36
ITPR1 Q14643 3/20 0.36
INPPL1 O15357 1/20 0.34
AKT1 P31749 1/20 0.34
ACHE P22303 1/20 0.33
CYP19A1 P11511 1/20 0.32

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
SCHEMBL2238965 0.87
SCHEMBL9484912 0.86 INPP5A (0.38) INPP5AACHECYP19A1
SCHEMBL9629720 0.80 ACHE (0.35) INPP5AACHECYP19A1
SCHEMBL2238021 0.77
SCHEMBL2149479 0.77 INPP5A (0.52) INPP5ASMPD1ITPR3ITPR2ITPR1
Methyl Alcohol SCHEMBL28863308 0.76 INPP5A (0.47) INPP5ASMPD1ITPR3ITPR2ITPR1
SCHEMBL25657149 0.76 INPP5A (0.47) INPP5ASMPD1ITPR3ITPR2ITPR1
SCHEMBL18231183 0.76 INPP5A (0.32) INPP5AACHE
SCHEMBL19808281 0.76 INPP5A (0.43) INPP5ASMPD1
SCHEMBL14412710 0.75 INPP5A (0.50) INPP5ASMPD1ITPR3ITPR2ITPR1

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-4134098-A1 METHOD OF CANCER THERAPY ONO Pharmaceutical Co., Ltd. (JP) 2023-02-15 EP disclosed
EP-4134134-A1 STING AGONISTIC COMPOUND ONO Pharmaceutical Co., Ltd. (JP) 2023-02-15 EP disclosed