SCHEMBL7366672

SCHEMBL7366672

Cc1cc(=O)c2ccc(OCCCCl)cc2o1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
KCNA3 P22001 1/20 0.48
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48
PRKDC P78527 1/20 0.47
ACHE P22303 2/20 0.46
BCHE P06276 1/20 0.46

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
SCHEMBL11101571 0.87 BCHE (0.48) SIGMAR1KCNA3MAOAMAOBPRKDC
SCHEMBL9388140 0.83 MAOB (0.68) SIGMAR1MAOAMAOBACHEBCHE
SCHEMBL7904928 0.81 LOXL2 (0.48) SIGMAR1MAOAMAOBPRKDCACHE
SCHEMBL4039692 0.80 MAOB (0.73) KDM4EALDH1A1HPGDMAOBACHE
SCHEMBL11166439 0.80 KDM4E (0.46) KDM4EALDH1A1GAA
SCHEMBL10459171 0.80 SLC2A1 (0.71) KDM4EALDH1A1GAAHPGDMAOA
SCHEMBL7377495 0.80 EPHX2 (0.65) SIGMAR1KDM4EALDH1A1HPGDMAOA
SCHEMBL7372368 0.80 SIGMAR1 (0.72) SIGMAR1
SCHEMBL8783854 0.80 SLC2A1 (0.44) SIGMAR1KDM4EALDH1A1GAAHPGD
SCHEMBL9976083 0.79 MAOB (0.67) KDM4EALDH1A1GAAHPGDMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0699197-B1 4-P-FLUOROBENZOYL-1-PIPERIDINYL-PROPOXY-CHROMEN-4-ONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF PSYCHOSIS AND SCHIZOPHRENIA FERRER INT (ES) 2000-06-07 EP disclosed
US-5643927-A METHOD OF PREPARATION BY DEHYDROCHLORINATION BETWEEN 4-(P-FLUOROBENZOYLPIPERIDINE WITH CHLOROALKYLCHROMEN-4-ONE FERRER INTERNACIONAL, S.A. (ES) 1997-07-01 US disclosed
EP-0699197-A1 4-P-FLUOROBENZOYL-1-PIPERIDINYL-PROPOXY-CHROMEN-4-ONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF PSYCHOSIS AND SCHIZOPHRENIA FERRER INTERNACIONAL, S.A. (ES) 1996-03-06 EP disclosed
WO-1995025733-A1 4-P-FLUOROBENZOYL-1-PIPERIDINYL-PROPOXY-CHROMEN-4-ONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF PSYCHOSIS AND SCHIZOPHRENIA FERRER INTERNACIONAL, S.A. (ES) 1995-09-28 WO disclosed