SCHEMBL18171780

SCHEMBL18171780

CCNc1ccc2oc(=O)n(Cc3ccccc3)c2c1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 6/20 0.66
▸ CD74 P04233 2/20 0.66
▸ MAPT P10636 4/20 0.61
▸ TP53 P04637 3/20 0.57
▸ POLB P06746 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ IDO1 P14902 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.51

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
SCHEMBL18171805 0.84 ALDH1A1 (0.50) MIFCD74MAPTPOLBMEN1
SCHEMBL10874258 0.80 MIF (1.00) MIFCD74TP53POLBMEN1
SCHEMBL18805702 0.77 MIF (1.00) MIFCD74MAPTTP53POLB
SCHEMBL17807837 0.77 NPC1 (0.79) MIFCD74MAPTTP53POLB
SCHEMBL16554239 0.77 MIF (0.70) MIFCD74MAPTTP53POLB
SCHEMBL18171842 0.77 MIF (0.70) MIFCD74MAPTTP53POLB
SCHEMBL25124429 0.76 IDH1 (0.52) TP53POLBMEN1KMT2AALDH1A1
SCHEMBL16565537 0.76 MIF (0.76) MIFCD74POLBMEN1KMT2A
SCHEMBL244386 0.76 MIF (1.00) MIFCD74POLBMEN1KMT2A
SCHEMBL29906983 0.76 MIF (1.00) MIFCD74POLBMEN1KMT2A

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-20180072997-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY 2018-03-15 — — US disclosed
EP-3286174-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2018-02-28 — — EP disclosed
WO-2016172425-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV HEALTHCARE (NO.5) LIMITED (GB) 2016-10-27 — — 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-20180072997-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION EIF2AK2, POLR2H, POLR2E MIF 349/4885CD74 576/4885MAPT 1843/4885

“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.

Send feedback