SCHEMBL8524142

SCHEMBL8524142

CCC1CCC(=O)Nc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 10/20 0.46
DDB1 Q16531 3/20 0.46
BRD4 O60885 3/20 0.46
CREBBP Q92793 2/20 0.46
NPC1 O15118 1/20 0.43
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.40
HTR5A P47898 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
SCHEMBL29960387 0.84 CRBN (0.47) CRBNDDB1NPC1MAPK13MAPK12
SCHEMBL25789187 0.83 BRD4 (0.57) BRD4CREBBPALDH1A1MAPTHTR5A
SCHEMBL29960334 0.83 CRBN (0.43) CRBNDDB1NPC1MAPK13MAPK12
Hydrochloric Acid SCHEMBL29960573 0.83 CRBN (0.46) CRBNDDB1NPC1MAPK13MAPK12
Hydrochloric Acid SCHEMBL29960240 0.82 CRBN (0.42) CRBNDDB1NPC1MAPK13MAPK12
SCHEMBL29960386 0.80 CRBN (0.43) CRBNDDB1NPC1MAPK13MAPK12
SCHEMBL5025547 0.80 ALDH1A1 (0.50) CRBNDDB1NPC1MAPK13MAPK12
SCHEMBL29960465 0.80 CRBN (0.40) CRBNDDB1NPC1MAPK13MAPK12
SCHEMBL1347194 0.78 DDB1 (0.49) CRBNDDB1BRD4CREBBPNPC1
SCHEMBL6441308 0.76 CRBN (0.44) CRBNDDB1ALDH1A1

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-3508484-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2021-04-07 EP disclosed
WO-1999015524-A1 THIAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-04-01 WO disclosed