SCHEMBL9409657

SCHEMBL9409657

O=C(O)CC[C@H]1CC[C@H](N2Cc3cc(C4CCNCC4)ccc3C2=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IKZF2 Q9UKS7 3/20 0.44
ITGB3 P05106 9/20 0.42
ITGA2B P08514 9/20 0.42
ITGA2 P17301 4/20 0.42
HDAC4 P56524 1/20 0.40
MAOA P21397 2/20 0.38
IKZF1 Q13422 1/20 0.38
PARP1 P09874 1/20 0.38
HTR6 P50406 1/20 0.38
DGAT1 O75907 1/20 0.37

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
SCHEMBL9409660 1.00 IKZF2 (0.44) IKZF2ITGB3ITGA2BITGA2HDAC4
Hydrochloric Acid SCHEMBL9409587 0.99 IKZF2 (0.43) IKZF2ITGB3ITGA2BITGA2HDAC4
Hydrochloric Acid SCHEMBL9409626 0.91 ITGB3 (0.47) IKZF2ITGB3ITGA2BITGA2PARP1
Hydrochloric Acid SCHEMBL9409357 0.88 IKZF2 (0.42) IKZF2ITGB3ITGA2BITGA2HDAC4
Hydrochloric Acid SCHEMBL9409577 0.87 IKZF2 (0.45) IKZF2HDAC4MAOAIKZF1HTR6
Hydrochloric Acid SCHEMBL9409488 0.86 IKZF2 (0.41) IKZF2ITGB3ITGA2BHDAC4MAOA
Hydrochloric Acid SCHEMBL9409579 0.83 ITGB3 (0.42) IKZF2ITGB3ITGA2BITGA2HTR6
Hydrochloric Acid SCHEMBL9409533 0.80 ITGB3 (0.41) IKZF2ITGB3ITGA2BITGA2HDAC4
SCHEMBL23880766 0.75 PARP1 (0.47) IKZF2PARP1HTR6
SCHEMBL31482759 0.75 PARP1 (0.47) IKZF2PARP1HTR6

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
EP-0604800-A1 4- 4- 4-(carboxyalkyl)-phenyl amino carbonyl -phenyl -piperedines as aggregation inhibitors Dr. Karl Thomae GmbH (DE) 1994-07-06 EP disclosed