SCHEMBL22178704

SCHEMBL22178704

CC(C)c1ccc2c(c1)c1c3c4cc(-c5cccc6c5oc5ccccc56)ccc4n4c5ccc(C(C)C)cc5c(c5c6cc(-c7cccc8c7oc7ccccc78)ccc6n2c51)c34

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.47
PRKDC P78527 6/20 0.39
TNKS O95271 1/20 0.39
PARP1 P09874 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PARP2 Q9UGN5 1/20 0.39
GGPS1 O95749 1/20 0.37
PTGES2 Q9H7Z7 1/20 0.37
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
ATM Q13315 1/20 0.33
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
RORA P35398 1/20 0.31
RORC P51449 1/20 0.31
RORB Q92753 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL24601413 0.90 ALOX5 (0.57) ALOX5PRKDCGGPS1PTGES2PRMT5
SCHEMBL22178469 0.89 ALOX5 (0.47) ALOX5PRKDCTNKSPARP1TNKS2
SCHEMBL22178727 0.87 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2PRMT5
SCHEMBL9916157 0.84 ALOX5 (0.56) ALOX5PRKDCTNKSPARP1TNKS2
SCHEMBL22178599 0.80 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2PRMT5
SCHEMBL24601409 0.80 ALOX5 (0.57) ALOX5PRKDCGGPS1PTGES2PRMT5
SCHEMBL22178740 0.80 LMNA (0.39) PRMT5WDR77RORARORCRORB
SCHEMBL788722 0.80 ALOX5 (0.51) ALOX5PRKDCTNKSPARP1TNKS2
SCHEMBL26415737 0.79 ALOX5 (0.56) ALOX5PRKDCTNKSPARP1TNKS2
SCHEMBL21710644 0.79 ALOX5 (0.56) ALOX5PRKDCGGPS1PTGES2PRMT5

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-20200212315-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ELECTRONIC DEVICE, AND COMPOUND IDEMITSU KOSAN CO.,LTD. (JP) 2020-07-02 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-20200212315-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ELECTRONIC DEVICE, AND COMPOUND OR10J3, ESR1, NFE2L2 ALOX5 2448/4885PRKDC 4604/4885TNKS 4480/4885

“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.