SCHEMBL22199860

SCHEMBL22199860

c1ccc(-c2ccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6ccccc6n(-c6ccccc6)c5c43)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.39
CASP1 P29466 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
DHODH Q02127 2/20 0.39
KDM4E B2RXH2 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
ATM Q13315 1/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 2/20 0.37
HSP90AA1 P07900 1/20 0.37
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
IL1R1 P14778 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
GSR P00390 1/20 0.36

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
SCHEMBL22199859 0.97 HSD17B10 (0.41) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL19998009 0.93 HSD17B10 (0.39) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL22200015 0.91 L3MBTL1 (0.43) HSD17B10DHODHKDM4EL3MBTL1ATM
SCHEMBL20848137 0.90 HSD17B10 (0.41) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL17117643 0.90 L3MBTL1 (0.44) HSD17B10DHODHKDM4EL3MBTL1ATM
SCHEMBL19655155 0.89 KDM4E (0.42) HSD17B10CASP1HRH4DHODHKDM4E
SCHEMBL18877122 0.89 HSD17B10 (0.35) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL22199784 0.88 KDM4E (0.41) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL22199862 0.88 TUBB4A (0.35) DHODHKDM4EL3MBTL1ATMALDH1A1
SCHEMBL18926304 0.87 KDM4E (0.37) HSD17B10CASP1HRH4DHODHKDM4E

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 HSD17B10 4188/4885CASP1 735/4885HRH4 4762/4885

“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.