SCHEMBL16638800

SCHEMBL16638800

COSCCCSCCn1ccnc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 3/20 0.46
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ATM Q13315 1/20 0.41
KDM4E B2RXH2 2/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
PRKCI P41743 1/20 0.40
QPCT Q16769 1/20 0.39
LMNA P02545 1/20 0.38
CYP19A1 P11511 1/20 0.38

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
SCHEMBL16638796 0.80 TBXAS1 (0.44) TBXAS1MEN1KMT2AATMKDM4E
SCHEMBL21408418 0.79 TBXAS1 (0.58) TBXAS1KDM4ETP53TSHRPRKCI
SCHEMBL21408577 0.79 TBXAS1 (0.58) TBXAS1KDM4ETP53TSHRPRKCI
SCHEMBL21408447 0.76 TBXAS1 (0.65) TBXAS1TP53PRKCICYP19A1
SCHEMBL23120204 0.75 TBXAS1 (0.50) TBXAS1KDM4ETP53TSHRPRKCI
SCHEMBL1709955 0.74 TBXAS1 (0.53) TBXAS1KDM4ETP53TSHRPRKCI
SCHEMBL9046908 0.73 TBXAS1 (0.50) TBXAS1KDM4ETP53TSHRPRKCI
SCHEMBL18079807 0.73 TBXAS1 (0.50) TBXAS1KDM4ETP53TSHR
SCHEMBL25948430 0.71 TBXAS1 (0.59) TBXAS1KMT2AKDM4ETP53PRKCI
SCHEMBL8600458 0.71 TBXAS1 (0.52) TBXAS1KDM4ETP53TSHRPRKCI

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-2860183-A9 REACTIVE IONIC LIQUID AND ION-IMMOBILIZED METAL OXIDE PARTICLES PRODUCED USING SAME, ION-IMMOBILIZED ELASTOMER, AND TRANSDUCER Sumitomo Riko Company Limited (JP) 2015-05-27 EP disclosed
EP-2860183-A1 REACTIVE IONIC LIQUID AND ION-IMMOBILIZED METAL OXIDE PARTICLES PRODUCED USING SAME, ION-IMMOBILIZED ELASTOMER, AND TRANSDUCER Sumitomo Riko Company Limited (JP) 2015-04-15 EP disclosed