SCHEMBL19987513

SCHEMBL19987513

O=C(S)Nc1ccc(Cl)cc1F

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.61
RAB9A P51151 4/20 0.55
NPC1 O15118 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
HPGD P15428 1/20 0.55
MEN1 O00255 4/20 0.52
MAPT P10636 4/20 0.51
HTT P42858 2/20 0.51
TAS1R3 Q7RTX0 1/20 0.51
TAS1R1 Q7RTX1 1/20 0.51
TAS1R2 Q8TE23 1/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 2/20 0.48
LMNA P02545 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
RXFP1 Q9HBX9 2/20 0.48

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
SCHEMBL19707984 0.85 KMT2A (0.66) KMT2ARAB9ANPC1SMN1; SMN2HPGD
SCHEMBL3883922 0.83 KMT2A (0.63) KMT2ARAB9ANPC1SMN1; SMN2HPGD
SCHEMBL9835394 0.83 KMT2A (0.63) KMT2ARAB9ANPC1SMN1; SMN2HPGD
SCHEMBL3873599 0.81 KDM4E (0.62) KMT2ARAB9ANPC1SMN1; SMN2HPGD
SCHEMBL7758449 0.81 KMT2A (0.61) KMT2ARAB9ANPC1SMN1; SMN2HPGD
SCHEMBL29683063 0.81 KDM4E (0.62) KMT2ARAB9ANPC1SMN1; SMN2HPGD
SCHEMBL349268 0.81 KMT2A (0.61) KMT2ARAB9ANPC1SMN1; SMN2HPGD
SCHEMBL10519504 0.81 LMNA (0.55) KMT2ARAB9ANPC1SMN1; SMN2HPGD
SCHEMBL19987443 0.81 HTT (0.61) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL11435364 0.79 KMT2A (0.58) KMT2ARAB9ANPC1SMN1; SMN2HPGD

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 KMT2A 400/4885RAB9A 3832/4885NPC1 2350/4885
US-20180079712-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER IDO1, IDO2, INMT KMT2A 400/4885RAB9A 3832/4885NPC1 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.