SCHEMBL4644972

SCHEMBL4644972

COc1cc2c(c(OC)c1OC)C=C(/C=C/C(=O)N[C@@H]1CCCC[C@H]1NC(=O)/C=C/C1=Cc3c(cc(OC)c(OC)c3OC)CC1)CC2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
METAP2 P50579 1/20 0.38
RAB9A P51151 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
KDM4E B2RXH2 1/20 0.36
FGFR4 P22455 1/20 0.36
POLB P06746 1/20 0.35
PTGS2 P35354 1/20 0.35
PSMB11 A5LHX3 1/20 0.35
PSMA7 O14818 1/20 0.35
PSMB1 P20618 1/20 0.35
PSMA1 P25786 1/20 0.35
PSMA2 P25787 1/20 0.35
PSMA3 P25788 1/20 0.35
PSMA4 P25789 1/20 0.35
PSMB8 P28062 1/20 0.35
PSMB9 P28065 1/20 0.35
PSMA5 P28066 1/20 0.35
PSMB4 P28070 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
SCHEMBL4645198 0.81 KDM4E (0.51) KMT2AKDM4EPOLBPTGS2MEN1
SCHEMBL5570694 0.81 KDM4E (0.51) KMT2AKDM4EPOLBPTGS2MEN1
SCHEMBL5569532 0.77 ALDH1A1 (0.47) KMT2AKDM4EPTGS2MEN1BCHE
SCHEMBL5569531 0.77 ALDH1A1 (0.47) KMT2AKDM4EPTGS2MEN1BCHE
SCHEMBL6788079 0.77 KDM4E (0.52) KMT2AKDM4EMEN1
SCHEMBL6787091 0.72 ATM (0.41) KMT2AKDM4EPOLBMEN1
SCHEMBL4641710 0.71 KMT2A (0.56) KMT2AMETAP2KDM4EPSMB11PSMA7
SCHEMBL4640430 0.71 KMT2A (0.56) KMT2AMETAP2KDM4EPSMB11PSMA7
SCHEMBL4643756 0.71 KMT2A (0.56) KMT2AMETAP2KDM4EPSMB11PSMA7
SCHEMBL9607209 0.70 KMT2A (0.60) KMT2AMETAP2CTSSCTSKKDM4E

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
US-6297283-B1 EXCELLENT INHIBITORY EFFECT ON THE PRODUCTION OF AN IGE ANTIBODY AND ARE HENCE USEFUL AS ANTIALLERGIC AGENTS KOWA CO., LTD. (JP) 2001-10-02 US claimed
EP-0934924-B1 NOVEL DIAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2008-08-13 EP disclosed
US-6576642-B2 Inhibitors of the production of Ig E antibodies, antiallergens KOWA CO., LTD. (JP) 2003-06-10 US disclosed
US-20010039279-A1 Diamide compounds and compositions containing the same KOWA CO., LTD. (JP) 2001-11-08 US disclosed
US-6297283-B1 EXCELLENT INHIBITORY EFFECT ON THE PRODUCTION OF AN IGE ANTIBODY AND ARE HENCE USEFUL AS ANTIALLERGIC AGENTS KOWA CO., LTD. (JP) 2001-10-02 US disclosed
EP-0934924-A1 NOVEL DIAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME KOWA CO. LTD. (JP) 1999-08-11 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-20010039279-A1 Diamide compounds and compositions containing the same HRH4, HRH2, HRH1 KMT2A 843/4885METAP2 2447/4885RAB9A 3203/4885

“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.