SCHEMBL22199859

SCHEMBL22199859

c1ccc(-c2nc3ccccc3nc2-n2c3ccccc3c3c4ccccc4c4c5ccccc5n(-c5ccccc5)c4c32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.41
CASP1 P29466 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
KDM4E B2RXH2 5/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
HPGD P15428 1/20 0.40
IL1R1 P14778 1/20 0.38
HTT P42858 4/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
GSR P00390 1/20 0.37
MAPK1 P28482 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
PKM P14618 1/20 0.36
TSHR P16473 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
SCHEMBL22199860 0.97 HSD17B10 (0.39) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL19998009 0.95 HSD17B10 (0.39) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL20848137 0.92 HSD17B10 (0.41) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL18877122 0.91 HSD17B10 (0.35) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL24037020 0.89 HSD17B10 (0.43) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL17117643 0.89 L3MBTL1 (0.44) HSD17B10KDM4EL3MBTL1ATMALDH1A1
SCHEMBL23132408 0.89 ALDH1A1 (0.44) HSD17B10CASP1KDM4EALDH1A1GAA
SCHEMBL22199862 0.88 TUBB4A (0.35) KDM4EL3MBTL1ATMALDH1A1HTT
SCHEMBL22199784 0.88 KDM4E (0.41) HSD17B10CASP1HRH4KDM4EL3MBTL1
SCHEMBL22200015 0.88 L3MBTL1 (0.43) HSD17B10KDM4EL3MBTL1ATMALDH1A1

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.