SCHEMBL27399863

SCHEMBL27399863

CN(Cc1ccccc1)C(C(=O)c1cn(C)c2ccccc12)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
HAT1 O14929 2/20 0.49
EP300 Q09472 2/20 0.49
POLB P06746 1/20 0.48
ALDH1A1 P00352 2/20 0.47
MITF O75030 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TSHR P16473 1/20 0.46
ALOX12 P18054 1/20 0.46
NR4A2 P43354 1/20 0.45
HTT P42858 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
UTS2R Q9UKP6 1/20 0.43
TSPO P30536 1/20 0.41

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
Hydrochloric Acid SCHEMBL27395314 0.99 LMNA (0.53) LMNAHAT1EP300POLBALDH1A1
SCHEMBL15902165 0.74 POLB (0.57) LMNAHAT1EP300POLBALDH1A1
SCHEMBL5539343 0.74 POLB (0.57) LMNAHAT1EP300POLBALDH1A1
SCHEMBL27396427 0.74 POLB (0.57) LMNAHAT1EP300POLBALDH1A1
SCHEMBL4759834 0.74 LMNA (0.60) LMNAPOLBALDH1A1MITFMAPT
SCHEMBL4192667 0.73 EPHX1 (0.49) ALDH1A1KMT2A
SCHEMBL27601267 0.73 EPHX1 (0.49) ALDH1A1KMT2A
SCHEMBL27601264 0.73 NR4A2 (0.53) LMNAPOLBALDH1A1KMT2ATSHR
SCHEMBL27552132 0.73 LMNA (0.56) LMNAHAT1EP300POLBALDH1A1
Hydrochloric Acid SCHEMBL4208521 0.72 EPHX1 (0.47) ALDH1A1KMT2A

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
CN-1081676-A The indoles and the indazole derivatives that are used for the treatment and the prevention of cerebral disorders, their preparation and application SANKYO CO (JP) 1994-02-09 CN disclosed