SCHEMBL599844

SCHEMBL599844

O=c1cc2ccccc2n[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.44
PDE3A Q14432 3/20 0.44
PDE2A O00408 2/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.43
ACHE P22303 1/20 0.43
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
BTK Q06187 1/20 0.39
RAB9A P51151 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
NPC1 O15118 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL3384364 0.79 PDE3B (0.47) PDE3BPDE3APDE2AALDH1A1MAPT
SCHEMBL7140402 0.79 PRMT5 (0.44) GAAKMT2APRMT5WDR77FGFR1
SCHEMBL5844145 0.78 PDE3B (0.40) PDE3BPDE3APDE2AALDH1A1MAPT
SCHEMBL29569459 0.71 MAPT (0.46) PDE3BPDE3APDE2AALDH1A1MAPT
SCHEMBL9686737 0.71 GAA (0.63) PDE3BPDE3APDE2AALDH1A1MAPT
Acetamide SCHEMBL5843146 0.70 IKBKB (0.37) PDE3BPDE3APDE2AALDH1A1MAPT
SCHEMBL7447282 0.69 FKBP5 (0.53) PDE3BPDE3APDE2AALDH1A1MAPT
SCHEMBL7421917 0.68 HPGD (0.38) PDE3BPDE3APDE2AALDH1A1MAPT
SCHEMBL7547477 0.67 KDM4E (0.44) PDE3BPDE3APDE2AALDH1A1MAPT
SCHEMBL11389056 0.64 KDM4E (0.44) PDE3BPDE3APDE2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024006252-A1 DUAL INHIBITION OF MDM2 AND EIF2-ALPHA INDUCES CELL DEATH IN MULTIPLE CANCER CELL TYPES THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2024-01-04 WO claimed
US-20220202950-A1 COMPOSITIONS COMPRISING BACTERIALLY DERIVED INTACT MINICELLS FOR THERANOSTIC APPLICATIONS ENGENEIC MOLECULAR DELIVERY PTY LTD (AU) 2022-06-30 US claimed
WO-2020222161-A1 COMPOSITIONS COMPRISING BACTERIALLY DERIVED INTACT MINICELLS FOR THERANOSTIC APPLICATIONS ENGENEIC MOLECULAR DELIVERY PTY LTD (AU) 2020-11-05 WO claimed
US-10822374-B2 Cancer therapies and diagnostics DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-11-03 US claimed
US-20180008688-A1 METHOD AND COMPOSITIONS FOR ENHANCING IMMUNOTHERAPEUTIC TREATMENT OF A CANCER AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. 2018-01-11 US claimed
US-20170348266-A1 INHIBITION OF PROLINE CATABOLISM FOR THE TREATMENT OF CANCER AND OTHER THERAPEUTIC APPLICATIONS BUCK INSTITUTE FOR RESEARCH ON AGING 2017-12-07 US claimed
WO-2016077632-A2 INHIBITION OF PROLINE CATABOLISM FOR THE TREATMENT OF CANCER AND OTHER THERAPEUTIC APPLICATIONS BUCK INSTITUTE FOR RESEARCH ON AGING (US) 2016-05-19 WO claimed
US-20130331398-A1 MODULATION OF UBIQUITINATION OF SYNAPTIC PROTEINS FOR THE TREATMENT OF NEURODEGENERATIVE AND PSYCHIATRIC DISORDERS UNIVERSITY OF MASSACHUSETTS (US) 2013-12-12 US claimed
WO-2012065182-A2 MODULATION OF UBIQUITINATION OF SYNAPTIC PROTEINS FOR THE TREATMENT OF NEURODEGENERATIVE AND PSYCHIATRIC DISORDERS UNIVERSITY OF MASSACHUSETTS (US) 2012-05-18 WO claimed
US-7090828-B2 Vitronectin receptor antagonist pharmaceuticals BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2006-08-15 US claimed
US-6569402-B1 Targeting moiety that binds to receptor upregulated during angiogenesis, and a radioisotope or diagnostically imageable moiety; receptor integrin and compound is a benzodiazepine, benzodiazepinedione, or dibenzotrihydroannulene nonapeptide BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-05-27 US claimed
EP-1311292-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS Bristol-Myers Squibb Pharma Company (US) 2003-05-21 EP claimed
US-20020019013-A1 Combined resin method for high-speed synthesis of combinatorial libraries ADVANCED SYNTECH, LLC 2002-02-14 US claimed
WO-2001097861-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-12-27 WO claimed
EP-1140864-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS Du Pont Pharmaceuticals Company (US) 2001-10-10 EP claimed
WO-2001030769-A2 PROCESS FOR ALKYLATION OF BENZODIAZEPINDIONE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2001-05-03 WO claimed
WO-2000035887-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS DU PONT PHARM CO (US) 2000-06-22 WO claimed
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP claimed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP claimed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20170348266-A1 INHIBITION OF PROLINE CATABOLISM FOR THE TREATMENT OF CANCER AND OTHER THERAPEUTIC APPLICATIONS GLUL, GLS2, PHGDH PDE3B 3247/4885PDE3A 3276/4885PDE2A 3116/4885
US-10822374-B2 Cancer therapies and diagnostics TP53, TP53BP1, MYC PDE3B 4494/4885PDE3A 4527/4885PDE2A 4463/4885
US-20020019013-A1 Combined resin method for high-speed synthesis of combinatorial libraries CPSF1, CPSF6, PLAU PDE3B 2379/4885PDE3A 2150/4885PDE2A 2503/4885

“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.