SCHEMBL22199875

SCHEMBL22199875

c1ccc2c(-c3nc(-n4c5ccccc5c5c6ccccc6c6c7ccccc7oc6c54)nc4ccccc34)cccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 7/20 0.32
KDM4E B2RXH2 6/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
ADORA2A P29274 1/20 0.32
HPGD P15428 5/20 0.32
MAPT P10636 4/20 0.32
HSD17B10 Q99714 3/20 0.32
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
FLT3 P36888 1/20 0.30
BMX P51813 1/20 0.30
TUBB4A P04350 1/20 0.30
TUBB P07437 1/20 0.30
TUBA3C P0DPH7 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
SCHEMBL19986102 0.94 RAB9A (0.33) RAB9ANPC1ALDH1A1KDM4EMEN1
SCHEMBL17464046 0.94 KDM4E (0.33) RAB9ANPC1ALDH1A1KDM4EMEN1
SCHEMBL22199873 0.92 ALDH1A1 (0.36) RAB9ANPC1ALDH1A1KDM4EMEN1
SCHEMBL22199964 0.92 PRKDC (0.35) RAB9ANPC1ALDH1A1KDM4EMEN1
SCHEMBL17451739 0.90 KDM4E (0.33) RAB9ANPC1ALDH1A1KDM4EMEN1
SCHEMBL19428622 0.88 L3MBTL1 (0.34) ALDH1A1KDM4EMEN1KMT2AADORA2A
SCHEMBL17427581 0.87 ALDH1A1 (0.45) RAB9ANPC1ALDH1A1KDM4EMEN1
SCHEMBL19986112 0.86 NPC1 (0.33) RAB9ANPC1ALDH1A1KDM4EADORA2A
SCHEMBL22011940 0.86
SCHEMBL19986110 0.85 PRKDC (0.34) RAB9ANPC1ALDH1A1KDM4EADORA2A

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-20200216392-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2020-07-09 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-20200216392-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME TERF2, PIEZO1, TERT RAB9A 1232/4885NPC1 3704/4885ALDH1A1 450/4885

“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.