SCHEMBL29348355

SCHEMBL29348355

O=C1CCC(c2cccc(-c3ccc(OCc4cccnc4)cc3)c2Cl)C(=O)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 1/20 0.43
PRKAG1 P54619 1/20 0.43
PRKAA2 P54646 1/20 0.43
PRKAA1 Q13131 1/20 0.43
PRKAG3 Q9UGI9 1/20 0.43
PRKAG2 Q9UGJ0 1/20 0.43
PRKAB1 Q9Y478 1/20 0.43
BRD4 O60885 2/20 0.41
CREBBP Q92793 2/20 0.41
CRBN Q96SW2 6/20 0.40
DDB1 Q16531 5/20 0.40
TRPA1 O75762 1/20 0.40
TYK2 P29597 1/20 0.39
GRM2 Q14416 1/20 0.39
CNR1 P21554 1/20 0.38
CD274 Q9NZQ7 3/20 0.38
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
MMP13 P45452 1/20 0.38

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
SCHEMBL29348356 0.90 CRBN (0.44) BRD4CREBBPCRBNDDB1CD274
SCHEMBL31068168 0.88 DDB1 (0.40) CRBNDDB1CD274PDCD1
SCHEMBL29348590 0.88 DDB1 (0.40) CRBNDDB1CD274PDCD1
SCHEMBL31068400 0.88 DDB1 (0.40) CRBNDDB1CD274PDCD1
SCHEMBL29348338 0.83 PDE10A (0.48) BRD4CREBBPCRBNDDB1TRPA1
SCHEMBL29348350 0.81 CRBN (0.49) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL29348431 0.81 CRBN (0.40) BRD4CREBBPCRBNDDB1CD274
SCHEMBL29348416 0.81 CRBN (0.47) CRBNDDB1CD274GPR119
SCHEMBL29348577 0.81 CRBN (0.44) CRBNDDB1CD274
SCHEMBL29348391 0.80 DDB1 (0.39) CRBNDDB1CD274PDCD1

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-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed