SCHEMBL7400946

SCHEMBL7400946

CCOC(=O)Cc1ccc(OCCN2CCC(Cc3ccc(Cl)cc3)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.52
TMEM97 Q5BJF2 1/20 0.52
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
ALDH1A1 P00352 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
LTA4H P09960 3/20 0.52
KDM4E B2RXH2 4/20 0.51
DRD3 P35462 1/20 0.51
MAOB P27338 1/20 0.49
HRH2 P25021 1/20 0.49
HRH1 P35367 1/20 0.49
TBXAS1 P24557 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL7406544 0.89 MEN1 (0.53) SIGMAR1TMEM97MEN1KMT2AALDH1A1
SCHEMBL7405934 0.86 MEN1 (0.56) SIGMAR1MEN1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL7405813 0.82 SIGMAR1 (0.64) SIGMAR1TMEM97LTA4H
SCHEMBL7397849 0.81 SIGMAR1 (0.62) SIGMAR1TMEM97LTA4HMAOB
SCHEMBL7399430 0.81 TMEM97 (0.63) SIGMAR1TMEM97MEN1KMT2ALTA4H
SCHEMBL7406504 0.79 SIGMAR1 (0.62) SIGMAR1TMEM97LTA4HDRD3NPSR1
SCHEMBL7406116 0.79 SIGMAR1 (0.62) SIGMAR1TMEM97LTA4HDRD3NPSR1
SCHEMBL7404898 0.79 SIGMAR1 (0.62) SIGMAR1TMEM97ALDH1A1LTA4H
SCHEMBL7406605 0.79 SIGMAR1 (0.82) SIGMAR1TMEM97MEN1KMT2AALDH1A1
SCHEMBL7409069 0.79 SIGMAR1 (0.82) SIGMAR1TMEM97MEN1KMT2AALDH1A1

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
US-6124323-A ACTIVE DRUG TREATING STROKE, CEREBRAL ISCHEMIA, CENTRAL NERVOUS SYSTEM TRAUMA, HYPOGLYCEMIA, ANXIETY, CONVULSIONS, AMIOGLYCOSIDE ANTIBIOTICS-INDUCED HEARING LOSS, MIGRAINE HEADACHES, CHRONIC PAIN, GLAUCOMA, CMV RETINITIS, PSYCHOSIS WARNER-LAMBERT COMPANY (US) 2000-09-26 US disclosed
EP-0869792-A4 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 1999-09-22 EP disclosed
EP-0869792-A2 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-10-14 EP disclosed
WO-1997023216-A1 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1997-07-03 WO disclosed