SCHEMBL18805683

SCHEMBL18805683

COc1cccc(Cn2c(=O)oc3ccc(O)cc32)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MIF P14174 10/20 1.00
CD74 P04233 5/20 0.78
TSHR P16473 5/20 0.51
LMNA P02545 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
USP2 O75604 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 3/20 0.49
MAPK1 P28482 2/20 0.49
HTT P42858 2/20 0.48
ATM Q13315 1/20 0.46
MAPT P10636 1/20 0.45

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
SCHEMBL3266381 0.90 MIF (1.00) MIFCD74TSHRLMNAL3MBTL1
SCHEMBL29566244 0.90 MIF (1.00) MIFCD74TSHRLMNAL3MBTL1
SCHEMBL18805700 0.87 MIF (1.00) MIFCD74TSHRLMNAL3MBTL1
SCHEMBL18805693 0.80 MIF (0.82) MIFCD74TSHRLMNAL3MBTL1
SCHEMBL2757854 0.77 MIF (0.70) MIFCD74TSHRLMNAL3MBTL1
SCHEMBL29566638 0.77 MIF (1.00) MIFCD74
SCHEMBL10089276 0.76 MIF (0.78) MIFCD74TSHRLMNAL3MBTL1
SCHEMBL29565887 0.76 MIF (1.00) MIFCD74TSHRLMNAL3MBTL1
SCHEMBL17167058 0.76 MIF (1.00) MIFCD74TSHRLMNAL3MBTL1
SCHEMBL18805704 0.74 MIF (0.81) MIFCD74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9643922-B2 MIF modulators YALE UNIVERSITY (US) 2017-05-09 US claimed
US-20230404980-A1 METHODS OF TREATING SPONDYLOARTHRITIS OR SYMPTOMS THEREOF UNIVERSITY HEALTH NETWORK (CA) 2023-12-21 US disclosed
EP-4237002-A1 METHODS OF TREATING SPONDYLOARTHRITIS OR SYMPTOMS THEREOF University Health Network (CA) 2023-09-06 EP disclosed
WO-2022087719-A1 METHODS OF TREATING SPONDYLOARTHRITIS OR SYMPTOMS THEREOF UNIVERSITY HEALTH NETWORK (CA) 2022-05-05 WO disclosed
US-10202343-B2 MIF modulators YALE UNIVERSITY (US) 2019-02-12 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-10202343-B2 MIF modulators MIF, HMGB2, HMGB3 MIF 1/4885CD74 15/4885TSHR 2619/4885
US-20230404980-A1 METHODS OF TREATING SPONDYLOARTHRITIS OR SYMPTOMS THEREOF MIF, SPAST, MMP12 MIF 1/4885CD74 34/4885TSHR 4177/4885

“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.