SCHEMBL7980334

SCHEMBL7980334

CNC(=O)c1cccc2c1OCC2

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.66
HCRTR1 O43613 1/20 0.44
HCRTR2 O43614 1/20 0.44
PLK1 P53350 1/20 0.44
BRD4 O60885 3/20 0.43
GAA P10253 1/20 0.42
BAZ2B Q9UIF8 2/20 0.42
SSTR4 P31391 4/20 0.42
KAT2B Q92831 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KCNA3 P22001 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
SCHEMBL28191054 0.91 PARP1 (0.54) PARP1HCRTR1HCRTR2PLK1BRD4
Hydrochloric Acid SCHEMBL28191050 0.89 PARP1 (0.53) PARP1HCRTR1HCRTR2PLK1BRD4
SCHEMBL14880539 0.85 PARP1 (0.68) PARP1HCRTR1HCRTR2GAASSTR4
SCHEMBL3645399 0.83 PARP1 (0.56) PARP1HCRTR1HCRTR2SSTR4KCNA3
SCHEMBL3360298 0.81 PARP1 (0.72) PARP1HCRTR1HCRTR2
SCHEMBL3639066 0.81 PARP1 (0.57) PARP1NPC1RAB9AKCNA3
SCHEMBL1065556 0.81 PARP1 (0.66) PARP1HCRTR1HCRTR2
SCHEMBL23657613 0.80 PARP1 (0.56) PARP1GAARAB9A
SCHEMBL1502069 0.80 PARP1 (1.00) PARP1HCRTR1HCRTR2
SCHEMBL729580 0.80 PARP1 (0.74) PARP1HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612134-A1 DIARYL DIAZOLE AND DIARYL TRIAZOLE DERIVATIVES FOR USE IN TREATING A DISEASE ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 EP disclosed
WO-2024095005-A1 DIARYL DIAZOLE AND DIARYL TRIAZOLE DERIVATIVES FOR USE IN TREATING A DISEASE ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 WO disclosed
EP-2884981-B1 4-HETEROARYL SUBSTITUTED BENZOIC ACID COMPOUNDS AS RORgammaT INHIBITORS AND USES THEREOF MERCK SHARP & DOHME (US) 2018-06-20 EP disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 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 (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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 PARP1 2800/4885HCRTR1 1642/4885HCRTR2 2247/4885

“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.