SCHEMBL23769780

SCHEMBL23769780

c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)oc5ccccc56)cc4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.34
MMP13 P45452 1/20 0.34
PLA2G2A P14555 2/20 0.31
PLA2G4A P47712 2/20 0.31
AHR P35869 1/20 0.31
ALOX5 P09917 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
HCRTR1 O43613 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL23769816 0.99 MMP12 (0.33) MMP12MMP13PLA2G2APLA2G4AAHR
SCHEMBL17855187 0.99 MMP12 (0.34) MMP12MMP13AHRALOX5KDM4E
SCHEMBL23770007 0.98 MMP12 (0.33) MMP12MMP13PLA2G2APLA2G4A
SCHEMBL21924655 0.98 MMP12 (0.33) MMP12MMP13PLA2G2APLA2G4A
SCHEMBL23769817 0.98 MMP12 (0.33) MMP12MMP13PLA2G2APLA2G4A
SCHEMBL23769809 0.97 MMP12 (0.32) MMP12MMP13HCRTR1
SCHEMBL23770010 0.97 MMP12 (0.32) MMP12MMP13
SCHEMBL23769864 0.97 MMP12 (0.32) MMP12MMP13HCRTR1
SCHEMBL23769782 0.96 HCRTR1 (0.32) MMP12MMP13HCRTR1
SCHEMBL17855222 0.96 PLA2G2A (0.34) MMP12MMP13PLA2G2APLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210253546-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2021-08-19 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-20210253546-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE RER1, ESR1, RFT1 MMP12 3995/4885MMP13 3942/4885PLA2G2A 3655/4885

“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.