SCHEMBL18805693

SCHEMBL18805693

COc1ccccc1Cn1c(=O)oc2cc(O)ccc21

nearest known ligand 0.82

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 6/20 0.82
▸ CD74 P04233 3/20 0.65
▸ MAPT P10636 1/20 0.57
▸ ATM Q13315 1/20 0.54
▸ TSHR P16473 5/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ LMNA P02545 1/20 0.51
▸ HPGD P15428 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ USP2 O75604 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ THRB P10828 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ HTT P42858 1/20 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
SCHEMBL29566244 0.90 MIF (1.00) MIFCD74MAPTATMTSHR
SCHEMBL3266381 0.90 MIF (1.00) MIFCD74MAPTATMTSHR
SCHEMBL18805683 0.80 MIF (1.00) MIFCD74MAPTATMTSHR
SCHEMBL29565887 0.79 MIF (1.00) MIFCD74TSHRL3MBTL1ALDH1A1
SCHEMBL17167058 0.79 MIF (1.00) MIFCD74TSHRL3MBTL1ALDH1A1
SCHEMBL10089276 0.79 MIF (0.78) MIFCD74ATMTSHRL3MBTL1
SCHEMBL2757855 0.78 MIF (0.70) MIFCD74TSHRALDH1A1LMNA
SCHEMBL18805706 0.78 MIF (0.62) MIFCD74MAPTALDH1A1
SCHEMBL2757854 0.72 MIF (0.70) MIFCD74TSHRL3MBTL1ALDH1A1
SCHEMBL14199075 0.72 MIF (0.48) MIFCD74TSHRALDH1A1HPGD

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 15/4885MAPT 3356/4885
US-20230404980-A1 METHODS OF TREATING SPONDYLOARTHRITIS OR SYMPTOMS THEREOF MIF, SPAST, MMP12 MIF 1/4885CD74 34/4885MAPT 1116/4885

“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.

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