SCHEMBL8007792

SCHEMBL8007792

CCc1nc2c(-c3cc(F)c(Cl)cc3Cl)cccc2n1CC(C)CC

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
PIK3C2B O00750 1/20 0.35
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL8007799 0.80
SCHEMBL7813559 0.73 TLR8 (0.41) SMN1; SMN2LMNATP53MAPTMEN1
SCHEMBL7813333 0.71
SCHEMBL7819032 0.67 LMNA (0.35) LMNAPIK3C2B
SCHEMBL7813653 0.67
SCHEMBL8004171 0.65
SCHEMBL7816740 0.65
SCHEMBL7821933 0.65 TLR8 (0.46) SMN1; SMN2TP53MAPTPOLB
SCHEMBL7816969 0.65 CCNT1 (0.40)
SCHEMBL7813707 0.62

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
US-6124463-A TREATMENT OF AFFECTIVE DISORDER, ANXIETY OR DEPRESSION DUPONT PHARMACEUTICALS (US) 2000-09-26 US disclosed