SCHEMBL9864350

SCHEMBL9864350

Clc1ccc(OC=C2C=C[CH]C=C2)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
LMNA P02545 1/20 0.32
CYP2A6 P11509 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL96633 0.64 HSD17B10 (0.46) MAOAMAOBLMNACYP2A6CA1
SCHEMBL194685 0.64 LMNA (0.42) MAOAMAOBLMNACYP2A6CA1
SCHEMBL28307146 0.64 LMNA (0.42) MAOAMAOBLMNACYP2A6CA1
SCHEMBL535420 0.64 LMNA (0.42) MAOAMAOBLMNACYP2A6CA1
SCHEMBL27525368 0.63 HSD17B10 (0.44) MAOAMAOBLMNACYP2A6CA1
SCHEMBL939907 0.63 HSD17B10 (0.44) MAOAMAOBLMNACYP2A6CA1
SCHEMBL3624201 0.61
SCHEMBL9065756 0.61 LMNA (0.38) MAOAMAOBLMNACYP2A6CA1
SCHEMBL9065752 0.61 LMNA (0.38) MAOAMAOBLMNACYP2A6CA1
SCHEMBL11444324 0.60 HPGD (0.39) MAOAMAOBLMNACYP2A6CA1

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
EP-0407955-A1 New hetrazepines acting as PAF antagonists, process for their production and their use as drugs BOEHRINGER INGELHEIM KG (DE) 1991-01-16 EP disclosed