SCHEMBL2476407

SCHEMBL2476407

Clc1cnc(Oc2ccccc2Oc2ncc(Cl)cc2Cl)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.67
CYP2C9 P11712 3/20 0.67
TSHR P16473 1/20 0.67
APEX1 P27695 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
MAPK1 P28482 1/20 0.57
CYP3A4 P08684 3/20 0.51
CYP2C19 P33261 3/20 0.51
CYP1A2 P05177 2/20 0.51
LIPE Q05469 4/20 0.50
HPGD P15428 2/20 0.49
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
BCHE P06276 1/20 0.43
KDM4E B2RXH2 2/20 0.42
POLB P06746 2/20 0.42
ALDH1A1 P00352 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CCR2 P41597 2/20 0.41
CCR4 P51679 2/20 0.41

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
SCHEMBL30434705 0.88 MAPK1 (0.58) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL29494845 0.80 SMN1; SMN2 (1.00) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL240269 0.80 SMN1; SMN2 (1.00) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL7055864 0.79 SMN1; SMN2 (0.64) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL7172986 0.78 SMN1; SMN2 (0.96) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL10644755 0.78 LMNA (0.57) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL14006333 0.78 CYP1A2 (0.49) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL11065229 0.77 MAPK1 (0.57) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL12386871 0.77 LMNA (0.83) LMNACYP2C9TSHRAPEX1SMN1; SMN2
SCHEMBL10818128 0.75 TSHR (0.54) LMNACYP2C9TSHRAPEX1SMN1; SMN2

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-2377530-A2 Modulation of neurogenesis by PDE inhibition Braincells, Inc. (US) 2011-10-19 EP disclosed