SCHEMBL20062594

SCHEMBL20062594

c1ccc2c(c1)-c1ccccc1-c1ccc3ncc(-c4cccc5c4sc4ccccc45)nc3c1-c1ccccc1-2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.38
▸ PARP14 Q460N5 1/20 0.36
▸ HTT P42858 1/20 0.34
▸ PAX8 Q06710 1/20 0.34
▸ PRKDC P78527 5/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ LIMK1 P53667 1/20 0.33
▸ CDK5 Q00535 1/20 0.33
▸ CDK5R1 Q15078 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ KRAS P01116 1/20 0.32
▸ NOS1 P29475 1/20 0.31
▸ GPR3 P46089 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL20062631 0.90 ALOX5 (0.38) ALOX5PARP14HTTPAX8PRKDC
SCHEMBL20062472 0.82 ALOX5 (0.41) ALOX5PARP14HTTPAX8PRKDC
SCHEMBL24596660 0.80 ALOX5 (0.43) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL20062587 0.80 PARP14 (0.40) ALOX5PARP14HTTPAX8PRKDC
SCHEMBL20062592 0.80 PARP14 (0.40) ALOX5PARP14HTTPAX8PRKDC
SCHEMBL20062593 0.80 PARP14 (0.40) ALOX5PARP14HTTPAX8PRKDC
SCHEMBL14925822 0.79 ALOX5 (0.43) ALOX5PARP14HTTPAX8PRKDC
SCHEMBL20062589 0.79 PARP14 (0.39) ALOX5PARP14HTTPAX8PRKDC
SCHEMBL20062585 0.79 PARP14 (0.39) ALOX5PARP14HTTPAX8PRKDC
SCHEMBL14826852 0.79 PARP14 (0.39) ALOX5PARP14HTTPAX8PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10608185-B2 Organic electroluminescent materials and devices UNIVERAL DISPLAY CORPORATION (US) 2020-03-31 — — US disclosed
US-20180108844-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2018-04-19 — — US disclosed
US-20180108844-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2018-04-19 — — 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 (2 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-20180108844-A1 Organic Electroluminescent Materials and Devices SLCO4C1, SLCO2A1, SLCO2B1 ALOX5 1559/4885PARP14 2592/4885HTT 1056/4885
US-10608185-B2 Organic electroluminescent materials and devices SLCO4C1, SLCO2A1, SLCO2B1 ALOX5 1559/4885PARP14 2592/4885HTT 1056/4885

“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.

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