SCHEMBL1287142

SCHEMBL1287142

O=C1c2ccccc2C(=O)c2sc(Nc3ccc(F)cc3)nc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
BCL2 P10415 1/20 0.48
DHODH Q02127 1/20 0.47
PTGDR2 Q9Y5Y4 2/20 0.46
CDK4 P11802 1/20 0.45
IDO1 P14902 3/20 0.45
TDO2 P48775 1/20 0.45
CCNA2 P20248 1/20 0.44
CDK2 P24941 1/20 0.44
MAPT P10636 5/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44

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
SCHEMBL1287081 0.88 BCL2 (0.49) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL1287130 0.86 BCL2 (0.48) RAB9ANPC1SMN1; SMN2BCL2DHODH
SCHEMBL1287085 0.85 DHODH (0.47) BCL2DHODHPTGDR2IDO1TDO2
SCHEMBL1287135 0.84 IDO1 (0.59) RAB9ANPC1SMN1; SMN2BCL2PTGDR2
SCHEMBL1287124 0.83 MEN1 (0.51) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL10220599 0.76 IDO1 (0.51) RAB9ANPC1SMN1; SMN2BCL2IDO1
SCHEMBL7805767 0.75 IDO1 (0.71) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL1287131 0.71 MAPT (0.47) SMN1; SMN2BCL2IDO1TDO2MAPT
SCHEMBL7805902 0.70 IDO1 (0.63) RAB9ANPC1SMN1; SMN2DHODHIDO1
SCHEMBL7815304 0.69 IDO1 (0.55) RAB9ANPC1SMN1; SMN2CASP3SENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9040713-B2 Methods of managing blood sugar levels and compositions related thereto EMORY UNIVERSITY (US) 2015-05-26 US disclosed
US-20130158082-A1 METHODS OF MANAGING BLOOD SUGAR LEVELS AND COMPOSITIONS RELATED THERETO EMORY UNIVERSITY (US) 2013-06-20 US disclosed
WO-2012047628-A2 METHODS OF MANAGING BLOOD SUGAR LEVELS AND COMPOSITIONS RELATED THERETO EMORY UNIVERSITY (US) 2012-04-12 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-20130158082-A1 METHODS OF MANAGING BLOOD SUGAR LEVELS AND COMPOSITIONS RELATED THERETO SLC5A1, SLC2A1, SLC5A2 RAB9A 1411/4885NPC1 328/4885SMN1; SMN2 1017/4885

“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.