SCHEMBL10616751

SCHEMBL10616751

CCOC(=O)NC1Cc2cccc3c(C(=O)c4ccccc4)ccc(c23)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.44
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 3/20 0.44
DRD2 P14416 1/20 0.41
MAPT P10636 1/20 0.41
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
ACHE P22303 2/20 0.39
ATM Q13315 1/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL10615382 0.86 KDM4E (0.53) HPGDALDH1A1KDM4EDRD2CA1
SCHEMBL10615410 0.82 KDM4E (0.49) HPGDALDH1A1KDM4EMAPTPOLB
SCHEMBL7909264 0.78 ATM (0.52) DRD2MAPTCA1CA2ACHE
SCHEMBL10616615 0.77 ATM (0.45) HPGDALDH1A1DRD2CA1CA2
SCHEMBL10616759 0.76 KDM4E (0.39) HPGDALDH1A1KDM4EMAPTPOLB
Carbamic Acid SCHEMBL7763164 0.76 ATM (0.48) DRD2MAPTCA1CA2ACHE
SCHEMBL10617633 0.74 ATM (0.36) HPGDALDH1A1DRD2MAPTCA1
SCHEMBL10615355 0.74 KDM4E (0.44) HPGDALDH1A1KDM4EMAPTPOLB
SCHEMBL7741128 0.73 ALDH1A1 (0.63) HPGDALDH1A1KDM4EMAPTATM
SCHEMBL3786131 0.70 MTNR1A (0.68) DRD2MAPTCA1CA2ACHE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0288477-A1 2,3-DIHYDRO-1H-PHENALENE-2-AMINO COMPOUNDS AS ANTI-PSYCHOTIC DRUGS THE UPJOHN COMPANY (US) 1988-11-02 EP disclosed
EP-0234113-A1 2,3-Dihydro-1H-phenalene-2-amino compounds as anti-psychotic drugs THE UPJOHN COMPANY (US) 1987-09-02 EP disclosed
WO-1987004153-A1 2,3-DIHYDRO-1H-PHENALENE-2-AMINO COMPOUNDS AS ANTI-PSYCHOTIC DRUGS THE UPJOHN COMPANY (US) 1987-07-16 WO disclosed