SCHEMBL1948088

SCHEMBL1948088

COC(=O)COc1ccc(F)cc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
CXCR2 P25025 6/20 0.40
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP1A2 P05177 1/20 0.36
HMGCR P04035 1/20 0.36
CXCR1 P25024 2/20 0.36
PTGDR Q13258 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
POLB P06746 1/20 0.36
LPL P06858 1/20 0.35
LIPG Q9Y5X9 1/20 0.35

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
SCHEMBL1946321 0.86 KDM4E (0.46) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL1947864 0.84 PPARG (0.46) ALDH1A1MAPTLMNAKMT2AKDM4E
SCHEMBL1948590 0.84 ALDH1A1 (0.40) ALDH1A1MAPTCXCR2LMNAMEN1
SCHEMBL12565395 0.84 MAPT (0.42) ALDH1A1MAPTCXCR2LMNAPKM
SCHEMBL31651983 0.80 LPL (0.40) CXCR2LPLLIPG
SCHEMBL16049143 0.80 LPL (0.41) ALDH1A1MAPTCXCR2PKMMEN1
SCHEMBL264121 0.79 LPL (0.39) CXCR2KMT2AKDM4ECYP1A2LPL
SCHEMBL268040 0.78 LPL (0.38) ALDH1A1MAPTCXCR2LMNALPL
SCHEMBL29686713 0.78 LPL (0.45) CXCR2KDM4ELPLLIPG
SCHEMBL6691405 0.78 LPL (0.45) CXCR2KDM4ELPLLIPG

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
US-20110136877-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2011-06-09 US disclosed
US-20110136877-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2011-06-09 US disclosed
EP-2240434-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS Ligand Pharmaceuticals Inc. (US) 2010-10-20 EP disclosed
WO-2009089192-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2009-07-16 WO 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-20110136877-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS HCAR2, PAH, PTGES2 ALDH1A1 281/4885MAPT 2797/4885CXCR2 659/4885

“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.