SCHEMBL21716964

SCHEMBL21716964

c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc2cc3c4ccccc4n(-c4ccc(-c5nc6ccccc6nc5-c5ccc6c(c5)sc5ccccc56)cc4)c3cc2c1

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.32
RPA1 P27694 1/20 0.32
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
PRSS1 P07477 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PMM2 O15305 1/20 0.31
MPI P34949 1/20 0.31
PHOSPHO1 Q8TCT1 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL21716681 0.99 F2 (0.32) HPGDRPA1F2F10PRSS1
SCHEMBL21213677 0.96 RPA1 (0.34) HPGDRPA1PMM2MPIPHOSPHO1
SCHEMBL21716489 0.94 F2 (0.31) F2F10PRSS1
SCHEMBL21716855 0.94 F2 (0.30) F2F10PRSS1
SCHEMBL21716709 0.92 HPGD (0.31) HPGDRPA1
SCHEMBL21717562 0.92 HPGD (0.31) HPGDRPA1
SCHEMBL21717611 0.92 RPA1 (0.31) HPGDRPA1
SCHEMBL21716860 0.92 RPA1 (0.31) HPGDRPA1
SCHEMBL21716205 0.91 HPGD (0.30) HPGD
SCHEMBL21716816 0.91 HPGD (0.30) HPGD

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 HPGD 652/4885RPA1 1848/4885F2 1187/4885
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1A1, CYP1B1, CRY1 HPGD 652/4885RPA1 1848/4885F2 1187/4885

“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.