SCHEMBL21710478

SCHEMBL21710478

CC(C)c1ccc(-c2cc3c4ccccc4n4c5ccc6ccccc6c5c(c2)c34)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.34
PIK3CD O00329 1/20 0.33
DHODH Q02127 1/20 0.33
TNKS O95271 1/20 0.32
PARP1 P09874 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
AKR1B1 P15121 1/20 0.32
RAB9A P51151 2/20 0.32
MAPT P10636 1/20 0.32
PAX8 Q06710 1/20 0.32
NOD2 Q9HC29 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
UGT2B7 P16662 1/20 0.31
CASR P41180 2/20 0.31
GAA P10253 1/20 0.31
EGFR P00533 1/20 0.31
MET P08581 1/20 0.31
NPC1 O15118 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
SCHEMBL22868338 0.91 AKR1B1 (0.34) PTGESPIK3CDDHODHAKR1B1
SCHEMBL22679469 0.89 NTSR1 (0.34) PTGESPIK3CD
SCHEMBL22858079 0.89 AKR1B1 (0.33) PTGESAKR1B1RAB9AL3MBTL1UGT2B7
SCHEMBL22858087 0.88 PIK3CD (0.35) PTGESPIK3CDDHODHTNKSPARP1
SCHEMBL21710472 0.87 PTGES (0.38) PTGESMAPTPAX8GAANPC1
SCHEMBL21710686 0.87 TNKS (0.39) DHODHTNKSPARP1TNKS2HDAC6
SCHEMBL21710705 0.86 PTGES (0.36) PTGESMAPTPAX8GAANPC1
SCHEMBL21710474 0.84 PTGES (0.35) PTGESMAPTPAX8GAANPC1
SCHEMBL21717820 0.84 DHODH (0.34) PIK3CDDHODHTNKSPARP1TNKS2
SCHEMBL21710479 0.83 HPRT1 (0.35) PTGESRAB9AMAPTL3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11723272-B2 Organic electroluminescence element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-08-08 US disclosed
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO., LTD. (JP) 2021-01-07 US disclosed
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2021-01-07 US disclosed
US-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-02-13 US disclosed
US-20200052212-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 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 (3 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-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE LEF1, L1CAM, ESR2 PTGES 2858/4885PIK3CD 3864/4885DHODH 3330/4885
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 PTGES 4031/4885PIK3CD 3584/4885DHODH 764/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 PTGES 4447/4885PIK3CD 4476/4885DHODH 644/4885

“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.