SCHEMBL9364431

SCHEMBL9364431

O=C(O)C=CC(=O)Nc1cccc(C(=O)O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 1/20 0.79
▸ LPAR2 Q9HBW0 3/20 0.77
▸ LPAR1 Q92633 1/20 0.77
▸ PARP1 P09874 5/20 0.77
▸ PARP10 Q53GL7 5/20 0.77
▸ PARP14 Q460N5 4/20 0.77
▸ PARP15 Q460N3 3/20 0.77
▸ ALDH1A1 P00352 5/20 0.72
▸ MAPT P10636 3/20 0.72
▸ LPAR3 Q9UBY5 3/20 0.72
▸ LTB4R Q15722 1/20 0.63
▸ MEN1 O00255 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ KDM4E B2RXH2 2/20 0.55
▸ POLB P06746 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54

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
SCHEMBL9364423 1.00 CREBBP (0.79) CREBBPLPAR2LPAR1PARP1PARP10
SCHEMBL15798246 1.00 CREBBP (0.79) CREBBPLPAR2LPAR1PARP1PARP10
SCHEMBL17395887 0.89 CREBBP (1.00) CREBBPLPAR2LPAR1PARP1PARP10
SCHEMBL17395885 0.89 CREBBP (1.00) CREBBPLPAR2LPAR1PARP1PARP10
SCHEMBL441804 0.88 LPAR2 (1.00) CREBBPLPAR2LPAR1PARP1PARP10
SCHEMBL1552033 0.88 LPAR2 (1.00) CREBBPLPAR2LPAR1PARP1PARP10
SCHEMBL441805 0.88 LPAR2 (1.00) CREBBPLPAR2LPAR1PARP1PARP10
Iodide SCHEMBL1552156 0.86 LPAR2 (0.96) CREBBPLPAR2LPAR1PARP1PARP10
SCHEMBL22272087 0.85 CREBBP (0.63) CREBBPLPAR2LPAR1PARP1PARP10
SCHEMBL11011737 0.84 CREBBP (0.81) CREBBPLPAR2LPAR1PARP1PARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0403240-B1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS (JP) 1994-08-24 — — EP claimed
EP-0372922-B1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS (JP) 1994-03-09 — — EP claimed
US-5175309-A Forming an imide by heat catalytic dehydration MITSUI TOATSU CHEMICALS INC. (JP) 1992-12-29 — — US claimed
US-5068357-A Heat dehydration of an N-substituted maleamic acid with a solvent, distillation after imidation, in the presence of a tin catalyst MITSUI TOATSU CHEMICALS, INC. (JP) 1991-11-26 — — US claimed
EP-0403240-A1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-12-19 — — EP claimed
EP-0372922-A2 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-06-13 — — EP claimed
EP-2931280-B1 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS INC (US) 2018-02-14 — — EP disclosed
US-9340532-B2 Methods and compositions for inhibiting CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2016-05-17 — — US disclosed
US-20150307482-A1 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2015-10-29 — — US disclosed
EP-2931280-A2 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 Phusis Therapeutics Inc. (US) 2015-10-21 — — EP disclosed
WO-2014093988-A2 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2014-06-19 — — WO disclosed
EP-0403240-B1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS (JP) 1994-08-24 — — EP disclosed
EP-0372922-B1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS (JP) 1994-03-09 — — EP disclosed
US-5175309-A Forming an imide by heat catalytic dehydration MITSUI TOATSU CHEMICALS INC. (JP) 1992-12-29 — — US disclosed
US-5068357-A Heat dehydration of an N-substituted maleamic acid with a solvent, distillation after imidation, in the presence of a tin catalyst MITSUI TOATSU CHEMICALS, INC. (JP) 1991-11-26 — — US disclosed
EP-0403240-A1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-12-19 — — EP disclosed
EP-0372922-A2 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-06-13 — — EP 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-20150307482-A1 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 CNKSR1, CAMKK1, CAMKK2 CREBBP 510/4885LPAR2 834/4885LPAR1 565/4885

“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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