SCHEMBL2555412

SCHEMBL2555412

NC(=O)c1ccc(Oc2ccc(C=O)cc2)c(F)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 9/20 0.65
PARP3 Q9Y6F1 1/20 0.65
PARP15 Q460N3 3/20 0.46
PARP14 Q460N5 2/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46
PARP16 Q8N5Y8 1/20 0.46
PARP11 Q9NR21 1/20 0.46
PARP4 Q9UKK3 1/20 0.46
OPRK1 P41145 7/20 0.45
OPRM1 P35372 6/20 0.45
OPRD1 P41143 6/20 0.45
TNKS O95271 1/20 0.44
TNKS2 Q9H2K2 1/20 0.44
PARP2 Q9UGN5 1/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
F2 P00734 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40

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
SCHEMBL30569945 1.00 PARP10 (0.65) PARP10PARP3PARP15PARP14ALDH1A1
SCHEMBL15330339 0.91 PARP10 (0.65) PARP10PARP3PARP15PARP14ALDH1A1
SCHEMBL13772124 0.87 PARP10 (0.51) PARP10PARP3ALDH1A1OPRK1OPRM1
SCHEMBL3024115 0.85 PARP10 (0.67) PARP10PARP15PARP14ALDH1A1KMT2A
SCHEMBL27245278 0.84 PARP10 (0.62) PARP10PARP15PARP14ALDH1A1KMT2A
SCHEMBL3691706 0.83 PARP10 (0.65) PARP10PARP3PARP15PARP14ALDH1A1
SCHEMBL3701320 0.83 PARP10 (0.65) PARP10PARP3PARP15PARP14ALDH1A1
SCHEMBL3693691 0.82 PARP10 (0.64) PARP10PARP3PARP15PARP14ALDH1A1
SCHEMBL21628730 0.82 PARP10 (0.59) PARP10PARP15PARP14ALDH1A1KMT2A
SCHEMBL26214383 0.82 PARP10 (0.63) PARP10PARP15PARP14ALDH1A1KMT2A

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 68 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326714-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT JANSSEN PHARMACEUTICALS INC (US) 2025-10-23 US claimed
EP-4489748-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. (US) 2025-01-15 EP claimed
US-20230348377-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. 2023-11-02 US claimed
WO-2023170547-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. (US) 2023-09-14 WO claimed
US-20250326714-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT JANSSEN PHARMACEUTICALS INC (US) 2025-10-23 US disclosed
EP-4489748-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. (US) 2025-01-15 EP disclosed
US-20230348377-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. 2023-11-02 US disclosed
US-20230348377-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. 2023-11-02 US disclosed
US-20230348377-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. 2023-11-02 US disclosed
WO-2023170547-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. (US) 2023-09-14 WO disclosed
WO-2023170547-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT Janssen Pharmaceuticals, Inc. (US) 2023-09-14 WO disclosed
US-20230277500-A1 COMPOSITIONS COMPRISING ATICAPRANT Janssen Pharmaceuticals, Inc. 2023-09-07 US disclosed
US-7381719-B2 Diaryl ethers as opioid receptor antagonist ELI LILLY AND COMPANY (US) 2008-06-03 US disclosed
US-7381719-B2 Diaryl ethers as opioid receptor antagonist ELI LILLY AND COMPANY (US) 2008-06-03 US disclosed
EP-1562595-B1 DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2008-05-21 EP disclosed
US-20060217372-A1 Diaryl ethers as opioid receptor antagonist ELI LILLY AND COMPANY 2006-09-28 US disclosed
CN-1681498-A Diaryl ethers as opioid receptor antagonist LILLY CO ELI (US) 2005-10-12 CN disclosed
EP-1562595-A1 DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-08-17 EP disclosed
WO-2004026305-A9 DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONIST LILLY CO ELI (US) 2004-05-13 WO disclosed
WO-2004026305-A1 DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONIST ELI LILLY AND COMPANY (US) 2004-04-01 WO 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 (4 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-20230277500-A1 COMPOSITIONS COMPRISING ATICAPRANT ADORA1, ADORA2B, ADORA2A PARP10 1229/4885PARP3 416/4885PARP15 897/4885
US-20230348377-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT ATIC, ADORA1, ADORA2A PARP10 4198/4885PARP3 3010/4885PARP15 4244/4885
US-20250326714-A1 PURE FORMS OF CRYSTALLINE ATICAPRANT ATIC, ADORA1, ADORA2A PARP10 4198/4885PARP3 3010/4885PARP15 4244/4885
US-20060217372-A1 Diaryl ethers as opioid receptor antagonist OPRM1, OPRL1, OPRD1 PARP10 2434/4885PARP3 4263/4885PARP15 4274/4885

“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.