SCHEMBL6130240

SCHEMBL6130240

COCOc1c(-c2ccccc2)cc2ccccc2c1-c1c(OCOC)c(-c2ccccc2)cc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 9/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ EGFR P00533 2/20 0.40
▸ HPGD P15428 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MPI P34949 1/20 0.39
▸ ALOX5 P09917 3/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 1/20 0.38
▸ RECQL P46063 1/20 0.38

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
SCHEMBL31206983 1.00 GPR84 (0.42) GPR84MEN1KMT2AKDM4EEGFR
SCHEMBL22229815 0.85 GPR84 (0.37) GPR84KDM4EEGFRHPGDALDH1A1
SCHEMBL22229661 0.83 ALOX5 (0.46) GPR84KDM4EHPGDLMNAALDH1A1
SCHEMBL30364255 0.83 ALOX5 (0.46) GPR84KDM4EHPGDLMNAALDH1A1
SCHEMBL25485149 0.82 ALDH1A1 (0.38) GPR84KDM4EHPGDALDH1A1NPSR1
SCHEMBL3922387 0.82 KDM4E (0.51) GPR84MEN1KMT2AKDM4EHPGD
SCHEMBL22187663 0.81 GPR84 (0.48) GPR84MEN1KMT2AKDM4EHPGD
SCHEMBL29506852 0.81 GPR84 (0.48) GPR84MEN1KMT2AKDM4EHPGD
SCHEMBL22229718 0.81 MAPT (0.45) GPR84MEN1KMT2AKDM4EHPGD
SCHEMBL22229662 0.81 GPR84 (0.33) GPR84MEN1KMT2AKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1341797-A4 ORTHO SUBSTITUTED CHIRAL PHOSPHINES AND PHOSPHINITES AND THEIR USE IN ASYMMETRIC CATAYLTIC REACTIONS PENN STATE RES FOUND (US) 2005-06-15 — — EP disclosed
US-6855657-B2 Ortho substituted chiral phosphines and phosphinites and their use in asymmetric catalytic reactions THE PENN STATE RESEARCH FOUNDATION (US) 2005-02-15 — — US disclosed
US-20040068126-A1 Ortho substituted chiral phosphines and phosphinites and their use in asymmetric catalytic reactions THE PENN STATE RESEARCH FOUNDATION 2004-04-08 — — US disclosed
EP-1341797-A1 ORTHO SUBSTITUTED CHIRAL PHOSPHINES AND PHOSPHINITES AND THEIR USE IN ASYMMETRIC CATAYLTIC REACTIONS THE PENN STATE RESEARCH FOUNDATION (US) 2003-09-10 — — EP disclosed
WO-2002040491-A1 ORTHO SUBSTITUTED CHIRAL PHOSPHINES AND PHOSPHINITES AND THEIR USE IN ASYMMETRIC CATAYLTIC REACTIONS THE PENN STATE RESEARCH FOUNDATION (US) 2002-05-23 — — 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-20040068126-A1 Ortho substituted chiral phosphines and phosphinites and their use in asymmetric catalytic reactions BCKDK, PDK3, HCK GPR84 1195/4885MEN1 1900/4885KMT2A 975/4885

“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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