SCHEMBL259592

SCHEMBL259592

O=C1CC2(Cc3ccccc3C2)C(=O)N1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 8/20 0.44
DDB1 Q16531 2/20 0.44
AHR P35869 1/20 0.42
PDK2 Q15119 1/20 0.42
NPC1 O15118 1/20 0.41
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
MAPK14 Q16539 1/20 0.41
OTUD7B Q6GQQ9 1/20 0.40
TDP2 O95551 1/20 0.39
CASP3 P42574 1/20 0.39
CASP7 P55210 1/20 0.39
CASP9 P55211 1/20 0.39
CASP6 P55212 1/20 0.39
CASP8 Q14790 1/20 0.39
MAP3K14 Q99558 1/20 0.39
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL11066896 0.88 CRBN (0.44) CRBNDDB1NPC1MAPK13MAPK12
SCHEMBL22018277 0.86 CRBN (0.47) CRBNDDB1NPC1MAPK13MAPK12
SCHEMBL22904423 0.79 AHR (0.39) CRBNDDB1AHRPDK2NPC1
SCHEMBL15935912 0.79 ADRA2A (0.41) OTUD7BMAPTPOLBALDH1A1CALCRL
SCHEMBL260407 0.77 CA9 (0.45) CRBNNPC1TDP2CASP7MAPT
SCHEMBL11073635 0.77 TDP2 (0.47) AHRTDP2CALCRL
SCHEMBL11095671 0.75 HTT (0.41) CRBNDDB1CALCRLNPSR1
SCHEMBL261144 0.75 CALCRL (0.39) AHRPDK2OTUD7BPOLBALDH1A1
SCHEMBL260116 0.74 CRBN (0.45) CRBNTDP2MAPTPOLBALDH1A1
SCHEMBL13062459 0.74 PARP1 (0.40) CRBNDDB1NPC1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4307108-A DIABETES PFIZER INC. (US) 1981-12-22 US claimed
US-20220281831-A1 FUSED-GLUTARIMIDE CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2022-09-08 US disclosed
WO-2021011631-A1 FUSED-GLUTARIMIDE CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-01-21 WO disclosed
WO-2021011631-A1 FUSED-GLUTARIMIDE CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-01-21 WO disclosed
EP-2134342-B1 MONOCYCLIC ANILIDE SPIROLACTAM CGRP RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (US) 2013-01-30 EP disclosed
EP-2134342-B1 MONOCYCLIC ANILIDE SPIROLACTAM CGRP RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (US) 2013-01-30 EP disclosed
EP-1791843-B1 MONOCYCLIC ANILIDE SPIROLACTAM CGRP RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (US) 2012-08-29 EP disclosed
EP-1791843-B1 MONOCYCLIC ANILIDE SPIROLACTAM CGRP RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (US) 2012-08-29 EP disclosed
US-8148390-B2 Monocyclic anilide spirolactam CGRP receptor antagonists Merck, Sharp & Dohme, Corp. (US) 2012-04-03 US disclosed
US-8148390-B2 Monocyclic anilide spirolactam CGRP receptor antagonists Merck, Sharp & Dohme, Corp. (US) 2012-04-03 US disclosed
WO-2006031610-A2 BICYCLIC ANILIDE SPIROLACTAM CGRP RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2006-03-23 WO disclosed
WO-2006031491-A2 TRICYCLIC ANILIDE SPIROLACTAM CGRP RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2006-03-23 WO disclosed
WO-2006029153-A2 MONOCYCLIC ANILIDE SPIROLACTAM CGRP RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2006-03-16 WO disclosed
US-4925841-A ANTICONVULSANTS TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1990-05-15 US disclosed
US-4471124-A DIABETIC COMPLICATIONS PFIZER INC. (US) 1984-09-11 US disclosed
US-4471124-A DIABETIC COMPLICATIONS PFIZER INC. (US) 1984-09-11 US disclosed
US-4442114-A COMPLICATIONS OF DIABETES PFIZER INC. (US) 1984-04-10 US disclosed
US-4442114-A COMPLICATIONS OF DIABETES PFIZER INC. (US) 1984-04-10 US disclosed
US-4307108-A DIABETES PFIZER INC. (US) 1981-12-22 US disclosed
US-4307108-A DIABETES PFIZER INC. (US) 1981-12-22 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-20220281831-A1 FUSED-GLUTARIMIDE CRBN LIGANDS AND USES THEREOF CRBN, CRKL, CDR2 CRBN 1/4885DDB1 394/4885AHR 3842/4885

“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.