SCHEMBL19965762

SCHEMBL19965762

CCCCCC(C)(C)c1cc(F)ccc1F

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.40
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
CNR1 P21554 9/20 0.35
RIPK1 Q13546 1/20 0.34
NR3C1 P04150 4/20 0.34
NR3C2 P08235 3/20 0.33

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
SCHEMBL19464695 0.87 RIPK1 (0.36) SLC6A2SLC6A4RIPK1NR3C1NR3C2
SCHEMBL24836099 0.85 CNR2 (0.42) CNR2CNR1
SCHEMBL24252081 0.81 SOAT1 (0.35) CNR2SLC6A2SLC6A4RIPK1NR3C2
SCHEMBL24121391 0.80 IDO1 (0.36) RIPK1NR3C1NR3C2
SCHEMBL19413082 0.80 RIPK1 (0.41) RIPK1NR3C1NR3C2
SCHEMBL24333583 0.77 CA2 (0.44)
SCHEMBL22435799 0.77 CNR2 (0.41) CNR2CNR1
SCHEMBL19965715 0.76 SOAT1 (0.34) CNR2SLC6A2SLC6A4CNR1RIPK1
SCHEMBL18649480 0.73 RIPK1 (0.39) SLC6A2SLC6A4RIPK1NR3C2
SCHEMBL21474515 0.72 CNR2 (0.54) CNR2CNR1

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-10399933-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-03 US disclosed
US-20180072660-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER BRISTOL MYERS SQUIBB CO (US) 2018-03-15 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-20180072660-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER IDO1, IDO2, INMT CNR2 528/4885SLC6A2 1080/4885SLC6A4 874/4885
US-10399933-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer IDO1, IDO2, INMT CNR2 528/4885SLC6A2 1080/4885SLC6A4 874/4885

“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.