SCHEMBL7547386

SCHEMBL7547386

CC1=[C]c2c(ccc(Cl)c2Cl)C1c1cccc2cccnc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
NPSR1 Q6W5P4 2/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
SLC40A1 Q9NP59 4/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 2/20 0.36
MAPT P10636 3/20 0.35
CCR1 P32246 3/20 0.35
CCR8 P51685 3/20 0.35
HTT P42858 2/20 0.35
MMP2 P08253 2/20 0.35
TSHR P16473 2/20 0.35
TP53 P04637 2/20 0.35
CCR5 P51681 2/20 0.35
GMNN O75496 1/20 0.35
HSP90AA1 P07900 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL28517555 0.66 KDM4E (0.54) LMNANPSR1ALDH1A1POLBSLC40A1
SCHEMBL6131362 0.65 LMNA (0.42) LMNANPSR1ALDH1A1POLBGAA
SCHEMBL9186396 0.65 CCR1 (0.58) LMNANPSR1ALDH1A1POLBGAA
SCHEMBL7546290 0.64 MAPK1 (0.37) LMNANPSR1ALDH1A1GAASLC40A1
SCHEMBL5509833 0.64 MAPT (0.36) LMNANPSR1ALDH1A1POLBGAA
SCHEMBL5597461 0.64 PSMD14 (0.38) LMNAALDH1A1POLBSLC40A1KDM4E
Hydrochloric Acid SCHEMBL1071469 0.64 SMN1; SMN2 (0.43) LMNAALDH1A1GAASLC40A1KDM4E
SCHEMBL692866 0.64 MMP2 (0.61) LMNAALDH1A1SLC40A1KDM4EMAPT
SCHEMBL29358836 0.64 MMP2 (0.61) LMNAALDH1A1SLC40A1KDM4EMAPT
Hydrochloric Acid SCHEMBL27944920 0.64 CCR1 (0.56) LMNANPSR1ALDH1A1POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212333-A1 MONOCYCLOPENTADIENYL COMPLEXES OF CHROMIUM, MOLYBDENUM OR TUNGSTEN WITH A DONOR BRIDGE Basell Polyolefine GmbH (DE) 2002-06-12 EP disclosed
WO-2001012641-A1 MONOCYCLOPENTADIENYL COMPLEXES OF CHROMIUM, MOLYBDENUM OR TUNGSTEN WITH A DONOR BRIDGE BASELL POLYOLEFINE GMBH (DE) 2001-02-22 WO disclosed