SCHEMBL28061343

SCHEMBL28061343

O[C@H]1Cc2ccccc2Nc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
BRD4 O60885 1/20 0.43
CREBBP Q92793 1/20 0.43
ALDH1A1 P00352 2/20 0.41
MAPT P10636 4/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 3/20 0.38
NPC1 O15118 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPK1 P28482 2/20 0.38
AHR P35869 1/20 0.38
PDK2 Q15119 1/20 0.38
HSP90AA1 P07900 1/20 0.38
THRB P10828 1/20 0.38
HK1 P19367 1/20 0.38
RECQL P46063 1/20 0.38
RAB9A P51151 1/20 0.38
GALK1 P51570 1/20 0.38
BLM P54132 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
SCHEMBL13748726 0.79 IDH1 (0.44) TSHR
SCHEMBL14084313 0.78 ALOX15 (0.48) GAAALOX15
SCHEMBL8693351 0.77 ALDH1A1 (0.62) TSHRBRD4CREBBPALDH1A1GAA
SCHEMBL21693355 0.77 TSHR (0.54) TSHRBRD4CREBBPALDH1A1MAPT
SCHEMBL4596354 0.77 CREBBP (0.51) TSHRBRD4CREBBPALDH1A1MAPT
SCHEMBL16870529 0.77 GRIN2D (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12228571 0.77
SCHEMBL28412785 0.77 MAOA (0.46) TSHRALDH1A1MAPTGAAMEN1
SCHEMBL30968744 0.77
SCHEMBL14313350 0.74 TSHR (0.51) TSHRBRD4CREBBPALDH1A1MAPT

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
CN-119504586-A Eslicarbazepine acetate chiral intermediate synthesis method 深圳格林凯特医药技术有限公司 2025-02-25 CN disclosed
CN-105384689-A Improved synthesis method of eslicarbazepine acetate KAIFENG PHARMACEUTICAL (GROUP) CO LTD 2016-03-09 CN disclosed