SCHEMBL13148641

SCHEMBL13148641

C=C(O)Cc1csc(-c2cc(F)cc(C(F)(F)F)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 4/20 0.45
HTT P42858 1/20 0.44
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
ALDH1A1 P00352 4/20 0.41
TP53 P04637 4/20 0.41
RHOC P08134 1/20 0.40
RHOA P61586 1/20 0.40
GAA P10253 2/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.36

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
SCHEMBL13148954 0.92 LMNA (0.47) KDM4ESMN1; SMN2LMNAHTTALDH1A1
SCHEMBL628096 0.87 KDM4E (0.64) KDM4ESMN1; SMN2LMNAHTTRXRA
SCHEMBL13148659 0.86 RHOC (0.47) KDM4ESMN1; SMN2LMNAHTTALDH1A1
SCHEMBL13148445 0.86 LMNA (0.43) KDM4ESMN1; SMN2LMNAHTTALDH1A1
SCHEMBL13150500 0.84 LMNA (0.42) KDM4ESMN1; SMN2LMNAHTTALDH1A1
SCHEMBL627651 0.79 LMNA (0.59) KDM4ESMN1; SMN2LMNAHTTRXRA
SCHEMBL13150483 0.77 MPL (0.51) KDM4ESMN1; SMN2LMNAHTTALDH1A1
SCHEMBL628077 0.74 RHOC (0.50) KDM4ELMNAHTTALDH1A1TP53
SCHEMBL13148538 0.73 KDM4E (0.45) KDM4ESMN1; SMN2LMNAHTTALDH1A1
SCHEMBL13150451 0.73 NOTUM (0.44) KDM4ESMN1; SMN2LMNAHTTALDH1A1

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
WO-2010120741-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (US) 2010-10-21 WO disclosed