SCHEMBL3061256

SCHEMBL3061256

CC(C)(C)OC(=O)N1c2ccccc2C[C@H]1CO

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
NOTUM Q6P988 1/20 0.46
BCHE P06276 1/20 0.43
NAMPT P43490 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALOX5AP P20292 1/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM1A O60341 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
SCHEMBL1760601 1.00 DRD2 (0.47) DRD2DRD4NOTUMBCHENAMPT
SCHEMBL29571640 1.00 DRD2 (0.47) DRD2DRD4NOTUMBCHENAMPT
SCHEMBL30681381 1.00 DRD2 (0.47) DRD2DRD4NOTUMBCHENAMPT
SCHEMBL30390423 1.00 DRD2 (0.47) DRD2DRD4NOTUMBCHENAMPT
SCHEMBL3441637 0.88 MTNR1A (0.43) BCHEMEN1KMT2A
SCHEMBL3441638 0.88 MTNR1A (0.43) BCHEMEN1KMT2A
SCHEMBL31051597 0.88 NOTUM (0.44) DRD2DRD4NOTUMBCHENAMPT
SCHEMBL31158605 0.88 NOTUM (0.44) NOTUMBCHENAMPTKDM1A
SCHEMBL19056685 0.88 NOTUM (0.44) NOTUMBCHENAMPTKDM1A
SCHEMBL5332801 0.86 AKT1 (0.45) NOTUMBCHENAMPTALOX5APNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586170-B Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative 江苏集萃分子工程研究院有限公司 2024-04-09 CN claimed
CN-117586170-A Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative 江苏集萃分子工程研究院有限公司 2024-02-23 CN claimed
US-20250171420-A1 MOLECULAR GLUE DEGRADERS AND METHODS OF USING THE SAME MONTE ROSA THERAPEUTICS AG (CH) 2025-05-29 US disclosed
CN-118139858-A Pyrazin-3 (2H) -one derivatives 吉利德科学公司 2024-06-04 CN disclosed
CN-117586170-B Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative 江苏集萃分子工程研究院有限公司 2024-04-09 CN disclosed
EP-3939981-B1 FUSED THIAZOLOPYRIMIDINE DERIVATIVES AS MNKS INHIBITORS LIFEARC (GB) 2024-04-03 EP disclosed
CN-117586170-A Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative 江苏集萃分子工程研究院有限公司 2024-02-23 CN disclosed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
US-20230183216-A1 PYRIDIZIN-3(2H)-ONE DERIVATIVES GILEAD SCIENCES, INC. 2023-06-15 US disclosed
US-20230183216-A1 PYRIDIZIN-3(2H)-ONE DERIVATIVES GILEAD SCIENCES, INC. 2023-06-15 US disclosed
WO-2023076983-A1 PYRIDIZIN-3(2H)-ONE DERIVATIVES GILEAD SCIENCES, INC. (US) 2023-05-04 WO disclosed
US-20140148452-A1 MORPHOLINO COMPOUNDS, USES AND METHODS UNIVERSITY OF DUNDEE (GB) 2014-05-29 US disclosed
US-20140148452-A1 MORPHOLINO COMPOUNDS, USES AND METHODS UNIVERSITY OF DUNDEE (GB) 2014-05-29 US disclosed
US-20100068301-A1 COMPOSITIONS AND TREATMENTS COMPRISING 5-LIPOXYGENASE-ACTIVATING PROTEIN INHIBITORS AND NITRIC OXIDE MODULATORS PANMIRA PHARMACEUTICALS, LLC 2010-03-18 US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
EP-2086531-A1 COMPOSITIONS AND TREATMENTS COMPRISING 5-LIPOXYGENASE-ACTIVATING PROTEIN INHIBITORS AND NITRIC OXIDE MODULATORS Amira Pharmaceuticals, Inc. (US) 2009-08-12 EP disclosed
WO-2008067566-A1 COMPOSITIONS AND TREATMENTS COMPRISING 5-LIPOXYGENASE-ACTIVATING PROTEIN INHIBITORS AND NITRIC OXIDE MODULATORS AMIRA PHARMACEUTICALS, INC. (US) 2008-06-05 WO disclosed
US-20070270587-A1 PYRIMIDOINDOLONES AND METHODS FOR USING SAME WYETH (US) 2007-11-22 US disclosed
US-7256198-B2 Pyrimidoindolones and methods for using same WYETH (US) 2007-08-14 US disclosed
US-20050250798-A1 E.g., 8-{[(2S)-2-(Methoxymethyl)pyrrolidin-1-yl]sulfonyl}-3,4-dihydropyrimido[1,2-a]indol-10(2H)-one; caspase inhibitors used to treat diseases including arthritis, myocardial infarction or stroke WYETH (US) 2005-11-10 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 (8 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-20140148452-A1 MORPHOLINO COMPOUNDS, USES AND METHODS HTR1A, HTR1E, HTR1D DRD2 19/4885DRD4 15/4885NOTUM 4872/4885
US-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS DRD2 2455/4885DRD4 3644/4885NOTUM 4472/4885
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 DRD2 915/4885DRD4 811/4885NOTUM 1979/4885
US-20100068301-A1 COMPOSITIONS AND TREATMENTS COMPRISING 5-LIPOXYGENASE-ACTIVATING PROTEIN INHIBITORS AND NITRIC OXIDE MODULATORS ALOX5, ALOX15B, PTGIS DRD2 4382/4885DRD4 4643/4885NOTUM 212/4885
US-20070270587-A1 PYRIMIDOINDOLONES AND METHODS FOR USING SAME TYMP, DPYD, TYMS DRD2 3552/4885DRD4 1539/4885NOTUM 3259/4885
US-20050250798-A1 E.g., 8-{[(2S)-2-(Methoxymethyl)pyrrolidin-1-yl]sulfonyl}-3,4-dihydropyrimido[1,2-a]indol-10(2H)-one; caspase inhibitors used to treat diseases including arthritis, myocardial infarction or stroke CASP1, API5, CASP8 DRD2 4147/4885DRD4 3716/4885NOTUM 3496/4885
US-20230183216-A1 PYRIDIZIN-3(2H)-ONE DERIVATIVES PIR, CYP3A43, CYP1A2 DRD2 1458/4885DRD4 1728/4885NOTUM 4621/4885
US-20250171420-A1 MOLECULAR GLUE DEGRADERS AND METHODS OF USING THE SAME PSMA1, CSNK1G1, CSNK1A1 DRD2 4529/4885DRD4 4727/4885NOTUM 2701/4885

“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.