SCHEMBL22199378

SCHEMBL22199378

CNc1cc(F)cc2c1C(O)(O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.47
▸ DDB1 Q16531 10/20 0.47
▸ ALDH1A1 P00352 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ IKZF3 Q9UKT9 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ TNF P01375 1/20 0.39

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
SCHEMBL24197080 0.77 CRBN (0.61) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25650405 0.77 CRBN (0.61) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL21281321 0.74 CRBN (0.50) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL24474085 0.73 CRBN (0.62) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL20458996 0.69 CRBN (0.65) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25010080 0.69 CRBN (0.51) CRBNDDB1IKZF3TNF
SCHEMBL30270680 0.69 CRBN (0.51) CRBNDDB1IKZF3TNF
SCHEMBL27373639 0.67 CRBN (0.50) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL21671654 0.67 CRBN (0.56) CRBNDDB1IKZF3TNF
SCHEMBL21671655 0.67 CRBN (0.56) CRBNDDB1IKZF3TNF

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-3214081-B1 ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF KANGPU BIOPHARMACEUTICALS LTD (CN) 2020-07-08 — — EP disclosed
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