SCHEMBL2063733

SCHEMBL2063733

COC(=O)C(C)c1ccc(C)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 7/20 0.50
ACHE P22303 1/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL8960120 0.84 SMN1; SMN2 (0.45) LPAR1
SCHEMBL8960117 0.84 SMN1; SMN2 (0.45) LPAR1
SCHEMBL1814210 0.83 ACHE (0.46) LPAR1ACHENPC1RAB9A
SCHEMBL3149952 0.82 MEN1 (0.41) NPC1RAB9A
SCHEMBL16219339 0.80 MT-CO2 (0.41)
SCHEMBL28968846 0.79 POLB (0.43)
SCHEMBL7960296 0.79 LPAR1 (0.50) LPAR1NPC1RAB9A
SCHEMBL5541713 0.79 LPAR1 (0.49) LPAR1ACHE
SCHEMBL10174511 0.79 SMN1; SMN2 (0.44)
SCHEMBL11069259 0.78 MT-CO2 (0.49) LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2062884-B1 Phenylacetic acid derivatives and pharmaceutical composition thereof FUJI YAKUHIN CO LTD (JP) 2013-02-20 EP disclosed
US-8148421-B2 Phenylacetic acid derivative FUJI YAKUHIN CO., LTD. (JP) 2012-04-03 US disclosed
US-20100048666-A1 NOVEL PHENYLACETIC ACID DERIVATIVE FUJI YAKUHIN CO., LTD. (JP) 2010-02-25 US disclosed
EP-2062884-A1 NOVEL PHENYLACETIC ACID DERIVATIVE Fuji Yakuhin Co., Ltd. (JP) 2009-05-27 EP disclosed
US-6569810-B1 (2-alkoxycarbonylcyclohexyl) (substituted benzyl) ketones of given formula; insecticidal, acaricidal and herbicidal action BAYER AKTIENGESELLSCHAFT (DE) 2003-05-27 US disclosed
US-6515184-B1 The present invention relates to novel bicyclic cyclopentane-1,3- dione derivatives of the formula (I) to a process for their preparation and to their use as pesticides and herbicides. BAYER AKTIENGESELLSCHAFT (DE) 2003-02-04 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-20100048666-A1 NOVEL PHENYLACETIC ACID DERIVATIVE PTGS1, PTGER1, PTGDR LPAR1 792/4885ACHE 4109/4885NPC1 2166/4885

“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.