SCHEMBL9826922

SCHEMBL9826922

Cc1ccc(N2C(=O)[C@H]3COC(c4ccccc4)N3C2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.47
▸ TP53 P04637 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ LMNA P02545 1/20 0.44
▸ HTT P42858 1/20 0.40
▸ F2 P00734 1/20 0.39
▸ ELANE P08246 1/20 0.39
▸ CTSG P08311 1/20 0.39
▸ CMA1 P23946 1/20 0.39
▸ CTRC Q99895 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MAPT P10636 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CACNA1B Q00975 1/20 0.37
▸ APBA1 Q02410 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
SCHEMBL9827209 0.87 POLB (0.46) TP53POLBLMNASMN1; SMN2ALDH1A1
SCHEMBL9827161 0.86 TSHR (0.50) POLBGAAMAPTKDM4EALDH1A1
SCHEMBL9826849 0.83 MAPT (0.43) POLBGAAHTTSMN1; SMN2MAPT
SCHEMBL9827174 0.80 TP53 (0.48) RAB9ATP53POLBGAALMNA
SCHEMBL9771408 0.79 KMT2A (0.42) TP53POLBLMNAF2ELANE
SCHEMBL9771318 0.76 TSHR (0.33) LMNAALDH1A1KMT2AL3MBTL1
SCHEMBL9827212 0.75 GAA (0.77) RAB9ATP53POLBGAALMNA
SCHEMBL9771422 0.71 EP300 (0.49) POLBF2ELANECTSGCMA1
SCHEMBL15131571 0.70 F2 (0.55) RAB9AGAALMNAHTTF2
SCHEMBL9827539 0.69 ALDH1A1 (0.36) POLBGAALMNAMAPTALDH1A1

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-0243734-B1 OPTICALLY ACTIVE HYDANTOIN MERCK PATENT GmbH (DE) 1991-07-17 — — EP disclosed
EP-0243734-A2 Optically active hydantoin MERCK PATENT GmbH (DE) 1987-11-04 — — EP disclosed
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