SCHEMBL8492013

SCHEMBL8492013

[CH2]C(Cc1cccs1)Oc1ccc(Cl)c2[nH]cc(Cl)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 3/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
MEN1 O00255 2/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
ALOX12 P18054 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP1A2 P05177 2/20 0.31
CYP2D6 P10635 2/20 0.31
ADRA1D P25100 2/20 0.31
SLC6A2 P23975 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
HTR2B P41595 1/20 0.31
MTOR P42345 1/20 0.31
HTR6 P50406 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL8489506 0.80 PPARA (0.34) SLC6A2SLC6A4SLC6A3
SCHEMBL8617146 0.78 PPARG (0.34)
SCHEMBL8489926 0.78 PPARA (0.34)
SCHEMBL8492009 0.76 HPGD (0.32) L3MBTL1SMN1; SMN2MAPK1
SCHEMBL7211962 0.74 HPGD (0.33) CYP2C19LMNANPC1MAPTRAB9A
SCHEMBL7207584 0.74 DRD2 (0.47) ALDH1A1MAPTL3MBTL1SMN1; SMN2MAPK1
SCHEMBL8659616 0.71 CACNA2D1 (0.38) CYP2C19KMT2ACYP1A2CYP2D6SLC6A2
SCHEMBL7466886 0.69 TRPA1 (0.30)
SCHEMBL7207588 0.67 SLC6A9 (0.32) SLC6A4
SCHEMBL7467290 0.67

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-5958965-A TREATMENT OF DISEASES ATTENDING DISTURBANCES IN THE SEROTINERGIC SYSTEMS, SUCH AS ANXIETY, STRESS, DEPRESSION, SEXUAL DYSFUNCTIONS AND SLEEP DISTURBANCES AMERICAN HOME PRODUCTS CORPORATION (US) 1999-09-28 US disclosed