SCHEMBL19987533

SCHEMBL19987533

COc1ccc(NC(=O)S)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
NPC1 O15118 4/20 0.56
GAA P10253 3/20 0.56
POLB P06746 1/20 0.51
ALDH1A1 P00352 3/20 0.49
MAPT P10636 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TP53 P04637 1/20 0.49
ABCB1 P08183 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
F10 P00742 1/20 0.47
PKM P14618 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46

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
SCHEMBL2095013 0.85 RAB9A (0.58) RAB9ASMN1; SMN2NPC1GAAPOLB
SCHEMBL2095011 0.85 RAB9A (0.57) RAB9ASMN1; SMN2NPC1GAAPOLB
SCHEMBL8320072 0.85 RAB9A (0.57) RAB9ASMN1; SMN2NPC1GAAPOLB
SCHEMBL14340498 0.81 TP53 (0.56) RAB9ASMN1; SMN2NPC1GAAPOLB
SCHEMBL19232045 0.81 RAB9A (0.56) RAB9ASMN1; SMN2NPC1GAAPOLB
SCHEMBL18026697 0.81 POLB (0.63) RAB9ASMN1; SMN2NPC1GAAPOLB
SCHEMBL19958218 0.80 TGM2 (0.58) RAB9ASMN1; SMN2NPC1GAAPOLB
SCHEMBL2090279 0.80 CYP1A2 (0.58) RAB9ASMN1; SMN2NPC1GAAALDH1A1
SCHEMBL23352868 0.78 RAB9A (0.70) RAB9ASMN1; SMN2NPC1GAAPOLB
SCHEMBL2090276 0.78 RAB9A (0.51) RAB9ASMN1; SMN2NPC1GAAPOLB

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-10399932-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-03 US disclosed
US-20180079712-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER BRISTOL MYERS SQUIBB CO (US) 2018-03-22 US 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 (2 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-10399932-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer IDO1, IDO2, INMT RAB9A 3832/4885SMN1; SMN2 4521/4885NPC1 2350/4885
US-20180079712-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER IDO1, IDO2, INMT RAB9A 3832/4885SMN1; SMN2 4521/4885NPC1 2350/4885

“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.