SCHEMBL7328852

SCHEMBL7328852

CC1=CNc2ccccc2C=C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
GAA P10253 1/20 0.50
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
P2RX4 Q99571 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
ALOX12 P18054 1/20 0.31
ACHE P22303 1/20 0.31

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
SCHEMBL9390020 0.76 MAPT (0.52) MAPTGAARAB9ASMN1; SMN2P2RX4
SCHEMBL31406264 0.74 GAA (0.50) MAPTGAA
SCHEMBL25290828 0.74 GAA (0.50) MAPTGAA
SCHEMBL27328216 0.74 MAPT (0.45) MAPTGAARAB9ASMN1; SMN2P2RX4
SCHEMBL11719213 0.74 GAA (0.45) MAPTGAASMN1; SMN2P2RX4
SCHEMBL4770605 0.74 MAPT (0.45) MAPTGAARAB9ASMN1; SMN2P2RX4
Hydrochloric Acid SCHEMBL30563096 0.72 GAA (0.48) MAPTGAA
SCHEMBL10345841 0.71 MAPT (0.42) MAPTGAARAB9ASMN1; SMN2P2RX4
SCHEMBL30890804 0.70 MAPT (0.41) MAPTGAARAB9ASMN1; SMN2P2RX4
SCHEMBL27383896 0.69 GAA (0.45) MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0080012-A1 6-Chloro-3-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine, its acid addition salts and its use as an intermediate SMITHKLINE BECKMAN CORPORATION (US) 1983-06-01 EP disclosed
EP-0007070-B1 2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINES, PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS HAVING DOPAMINE RECEPTOR BLOCKING ACTIVITY SMITHKLINE BECKMAN CORPORATION (US) 1983-01-19 EP disclosed
US-4265890-A ANTIPSYCHOTIC, ANTIEMETICS SMITHKLINE CORPORATION (US) 1981-05-05 US disclosed
US-4192872-A ANTI -PARKINSONISM ACTIVITY SMITHKLINE CORPORATION (US) 1980-03-11 US disclosed
EP-0007070-A1 2,3,4,5-Tetrahydro-1H-3-Benzazepines, process for their production and pharmaceutical compositions having dopamine receptor blocking activity SMITHKLINE BECKMAN CORPORATION (US) 1980-01-23 EP disclosed
US-4160765-A Method for 6-bromination of 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine compounds SMITHKLINE CORPORATION (US) 1979-07-10 US disclosed
US-4052506-A BENZAZEPINES SMITHKLINE CORPORATION (US) 1977-10-04 US disclosed
US-4011319-A STIMULATING DOPAMINE RECEPTORS, RENAL VASODILATORS, DIURETICS SMITHKLINE CORPORATION (US) 1977-03-08 US disclosed