SCHEMBL17819801

SCHEMBL17819801

O=[N+]([O-])c1cccc(O)c1Sc1cccc(Cl)c1Cl

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP7 Q93009 5/20 0.51
▸ USP47 Q96K76 2/20 0.51
▸ GPR35 Q9HC97 2/20 0.45
▸ LMNA P02545 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ ITGB2 P05107 1/20 0.41
▸ ICAM1 P05362 1/20 0.41
▸ ITGAL P20701 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ PDE7A Q13946 4/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ POLB P06746 1/20 0.37

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
SCHEMBL1341250 0.80 PDE7A (0.58) USP7USP47LMNAITGB2ICAM1
SCHEMBL12273009 0.74 ALDH1A1 (0.50) USP7USP47LMNAALDH1A1PDE7A
SCHEMBL1273865 0.72 GPR35 (0.62) GPR35ALDH1A1TSHRTDP1SMN1; SMN2
SCHEMBL30364804 0.72 GPR35 (0.62) GPR35ALDH1A1TSHRTDP1SMN1; SMN2
SCHEMBL27152086 0.72 USP7 (0.55) USP7USP47LMNAALDH1A1ITGB2
SCHEMBL12491961 0.72 ALDH1A1 (0.46) USP7USP47GPR35LMNAALDH1A1
SCHEMBL28282595 0.72 TDP1 (0.65) GPR35ALDH1A1TSHRTDP1SMN1; SMN2
SCHEMBL58157 0.72 TDP1 (0.65) GPR35ALDH1A1TSHRTDP1SMN1; SMN2
SCHEMBL29460277 0.72 TDP1 (0.65) GPR35ALDH1A1TSHRTDP1SMN1; SMN2
SCHEMBL29000828 0.71 GPR35 (0.60) GPR35ALDH1A1TSHRTDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3042900-B1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORP (JP) 2020-09-23 — — EP disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 — — US disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 — — US disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 — — US disclosed
EP-3042900-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF Fujifilm Corporation (JP) 2016-07-13 — — EP disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 — — US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 — — US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 — — 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 (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-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF PRMT7, RBBP7, RER1 USP7 1040/4885USP47 2441/4885GPR35 1869/4885

“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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