SCHEMBL21717029

SCHEMBL21717029

c1ccc2c(-c3nc4ccccc4nc3-c3ccc4ccc5ccccc5c4c3)cc(-n3c4ccccc4c4cc5cc(-n6c7ccccc7c7ccc8ccccc8c76)ccc5cc43)cc2c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
PRSS1 P07477 1/20 0.32
HPGD P15428 1/20 0.31
PDPK1 O15530 2/20 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
SCHEMBL21716847 0.94 HPGD (0.33) F2F10PRSS1HPGD
SCHEMBL21716479 0.94 HPGD (0.33) F2F10PRSS1HPGD
SCHEMBL21716771 0.92 F2 (0.34) F2F10PRSS1HPGDPDPK1
SCHEMBL21717016 0.91 F2 (0.34) F2F10PRSS1HPGDPDPK1
SCHEMBL21717652 0.91 HPGD (0.32) F2F10PRSS1HPGD
SCHEMBL21717674 0.89 PDPK1 (0.32) F2F10PRSS1PDPK1
SCHEMBL21717541 0.89 PTGES (0.32) F2F10PRSS1HPGD
SCHEMBL21716286 0.88 KDM4E (0.32)
SCHEMBL21717226 0.88 KDM4E (0.35) F2F10PRSS1HPGDPDPK1
SCHEMBL21716498 0.86 HPGD (0.33) F2F10PRSS1HPGDPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11192884-B2 Heterocyclic compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2021-12-07 US disclosed
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-13 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 (2 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-11192884-B2 Heterocyclic compound and organic light-emitting device comprising same CYP1A1, CYP1B1, CRY1 F2 1187/4885F10 2054/4885PRSS1 4439/4885
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1A1, CYP1B1, CRY1 F2 1187/4885F10 2054/4885PRSS1 4439/4885

“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.