SCHEMBL8936776

SCHEMBL8936776

Cn1nnc2ccc(Cc3ccc(Cl)cc3CO[Si](C)(C)C(C)(C)C)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.46
USP14 P54578 1/20 0.35
TSHR P16473 1/20 0.35
CASP3 P42574 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
CYP19A1 P11511 3/20 0.34
CYP11B1 P15538 1/20 0.34
CCNC P24863 1/20 0.32
CDK8 P49336 1/20 0.32
SLC9A1 P19634 2/20 0.32
KMO O15229 1/20 0.32
KEAP1 Q14145 3/20 0.31
PTK2 Q05397 1/20 0.31
FAAH O00519 1/20 0.31
NOTUM Q6P988 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL8936765 0.81 SLC6A4 (0.46) SLC6A4TSHRCASP3KMT2ASMN1; SMN2
SCHEMBL8936801 0.80 SLC6A4 (0.45) SLC6A4TSHRCASP3KMT2ASMN1; SMN2
SCHEMBL8936703 0.79 CYP19A1 (0.41) SLC6A4TSHRCASP3KMT2ASMN1; SMN2
SCHEMBL8936707 0.78 CYP19A1 (0.40) SLC6A4TSHRCASP3KMT2ASMN1; SMN2
SCHEMBL8936772 0.73 CYP19A1 (0.47) SLC6A4CYP19A1CYP11B1SLC9A1TDP1
SCHEMBL14476937 0.69 KEAP1 (0.53) SLC6A4KMT2ACYP19A1CYP11B1SLC9A1
SCHEMBL22517612 0.69 KDM5A (0.40) SLC6A4USP14KMT2A
SCHEMBL17494744 0.68 TDP1 (0.41) USP14KMT2ASMN1; SMN2TDP1
SCHEMBL22678373 0.67 MRGPRX4 (0.38) SLC6A4USP14KMT2ASMN1; SMN2
SCHEMBL21355982 0.66 PYCR1 (0.39) SLC6A4USP14TSHRKMT2ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5587392-A THERAPY FOR ESTROGEN DEPENDENT DISEASES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1996-12-24 US disclosed
EP-0684235-A1 Novel azolyl methyl phenyl derivatives having aromatase inhibitory activity MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-11-29 EP disclosed