SCHEMBL969334

SCHEMBL969334

COc1cc(C(=O)CCCCc2ccccc2)cc(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.59
LMNA P02545 2/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
HTT P42858 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
SCN5A Q14524 1/20 0.58
SCN2A Q99250 1/20 0.58
DPP4 P27487 1/20 0.55
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
ALOX5 P09917 2/20 0.53
LPAR1 Q92633 3/20 0.52
PDE4D Q08499 2/20 0.51
PDE4A P27815 1/20 0.51
PDE4B Q07343 1/20 0.51
PDE4C Q08493 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
SCHEMBL709246 0.96 TDP1 (0.60) TDP1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL972713 0.89 LPAR1 (0.58) TDP1DPP4NPC1RAB9ACASP3
SCHEMBL6819817 0.86 KMT2A (0.62) LMNAL3MBTL1SMN1; SMN2DPP4NPC1
SCHEMBL8549825 0.82 HPGD (0.61) TDP1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL708387 0.82 LMNA (0.58) TDP1LMNAL3MBTL1HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL8548328 0.81 HPGD (0.60) TDP1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL19438511 0.81 LPAR1 (0.62) TDP1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL7823257 0.81 ALDH1A1 (0.61) TDP1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL8549831 0.80 LMNA (0.53) TDP1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL7373375 0.80 TRPV1 (0.62) TDP1LMNAL3MBTL1HTTSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1695955-B1 COMPOUNDS HAVING LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISM AND USES THEREOF ONO PHARMACEUTICAL CO (JP) 2011-10-12 EP disclosed
US-7875745-B2 {1-[(2S,3S)-2-(2,3-dihydro-1H-inden-2-ylmethyl)-3-(3,5-dimethoxy-4- methylphenyl)-3-hydroxylpropyl]-1H-pyrrol-3-yl}acetic acid; for urinary system disease selected from the group of prostatic hypertrophy, neurogenic bladder dysfunction disease, dysuria, pollakiuria, night urination and urodynia ONO PHARMACEUTICAL CO., LTD. (JP) 2011-01-25 US disclosed
US-20070149595-A1 Compounds having lysophosphatidic acid receptor antagonism and uses thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-06-28 US disclosed
EP-1695955-A1 COMPOUNDS HAVING LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISM AND USES THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-08-30 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-20070149595-A1 Compounds having lysophosphatidic acid receptor antagonism and uses thereof LPAR2, LPAR1, LPAR5 TDP1 2538/4885LMNA 947/4885L3MBTL1 2260/4885

“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.