SCHEMBL630552

SCHEMBL630552

FC(F)(F)c1cc(-c2nc(Cc3nn[nH]n3)cs2)cc(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHOC P08134 1/20 0.39
RHOA P61586 1/20 0.39
CTSK P43235 1/20 0.35
TACR1 P25103 4/20 0.35
HSD11B1 P28845 2/20 0.35
PDPK1 O15530 1/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 1/20 0.34
POLB P06746 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 2/20 0.33
TP53 P04637 1/20 0.33
SRC P12931 1/20 0.32
CDK2 P24941 1/20 0.32
ZAP70 P43403 1/20 0.32
SYK P43405 1/20 0.32
KDM4E B2RXH2 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL13148918 0.93 POLB (0.39) RHOCRHOACTSKTACR1HSD11B1
SCHEMBL629987 0.79 NOTUM (0.53) RHOCRHOACTSKPDPK1
SCHEMBL627651 0.69 LMNA (0.59) RHOCRHOALMNAHTTPOLB
SCHEMBL13148954 0.69 LMNA (0.47) RHOCRHOALMNAHTTPOLB
SCHEMBL628077 0.66 RHOC (0.50) RHOCRHOALMNAHTTPOLB
SCHEMBL13113127 0.65 NOTUM (0.53) LMNAMAPTTAS2R14
SCHEMBL13113072 0.65 MAPT (0.51) HSD11B1KEAP1NFE2L2MAPT
SCHEMBL18005011 0.63 CTSS (0.39) RHOCRHOACTSKALDH1A1MAPT
SCHEMBL13148641 0.63 KDM4E (0.48) RHOCRHOALMNAHTTPOLB
SCHEMBL628096 0.63 KDM4E (0.64) RHOCRHOALMNAHTTALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102459203-A Compositions and methods for modulating retinol binding to retinol binding protein 4(RBP4) IRM LLC 2012-05-16 CN disclosed
US-20120077854-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (BM) 2012-03-29 US disclosed
US-20120077854-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (BM) 2012-03-29 US disclosed
EP-2419412-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (BM) 2012-02-22 EP disclosed
WO-2010120741-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (US) 2010-10-21 WO disclosed
WO-2010120741-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (US) 2010-10-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120077854-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) RBP4, RBP1, FABP4 RHOC 910/4885RHOA 3536/4885CTSK 4744/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.