SCHEMBL2897339

SCHEMBL2897339

O=C(O)Cc1nnn(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.42
POLB P06746 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
AKR1B1 P15121 2/20 0.36
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
DAGLA Q9Y4D2 3/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CNR2 P34972 1/20 0.33
MAPT P10636 1/20 0.33
ABCC4 O15439 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
PTGS1 P23219 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
MGLL Q99685 1/20 0.32

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
SCHEMBL3294672 0.85 POLB (0.41) HPGDPOLBSMN1; SMN2AKR1B1CYP2C19
SCHEMBL1121836 0.83 NOTUM (0.35) HPGDPOLBSMN1; SMN2DAGLAALDH1A1
Oxalic Acid SCHEMBL2438372 0.80 DAGLA (0.39) HPGDPOLBSMN1; SMN2DAGLAALDH1A1
SCHEMBL752388 0.79 POLB (0.33) POLBSMN1; SMN2DAGLAALDH1A1CNR2
SCHEMBL18982574 0.79 NOTUM (0.34) POLBSMN1; SMN2
SCHEMBL653830 0.79 CYP11B1 (0.33) POLBSMN1; SMN2TSHR
SCHEMBL5603377 0.78 TRPV1 (0.42) DAGLACNR2TSHRTRPV1MGLL
SCHEMBL30343520 0.76 POLB (0.32) POLBSMN1; SMN2CNR2TRPV1
SCHEMBL12327489 0.76 DAGLA (0.35) SMN1; SMN2DAGLA
SCHEMBL8131036 0.76 DAGLA (0.32) DAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100120743-A1 11Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2010-05-13 US disclosed
EP-1787982-B1 11Beta-Hydroxysteroid dehydrogenase type 1 active compounds HIGH POINT PHARMACEUTICALS LLC (US) 2010-05-12 EP disclosed
US-7700583-B2 Such as [4-(1,3,3-Trimethyl-6-aza-bicyclo[3.2.1]octane-6-carbonyl)-phenyl]carbamic acid tert-butyl ester; for treatment of metabolic syndrome HIGH POINT PHARMACEUTICALS, LLC (US) 2010-04-20 US disclosed
EP-1787982-A2 11Beta-Hydroxysteroid dehydrogenase type 1 active compounds Novo Nordisk A/S (DK) 2007-05-23 EP disclosed
US-20060089349-A1 11beta-hydroxysteroid dehydrogenase type 1 active compounds NOVO NORDISK A/S (DK) 2006-04-27 US disclosed
EP-1618090-A1 11ß-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS NOVO NORDISK A/S (DK) 2006-01-25 EP disclosed
CN-1178913-C Aromatic heterocycle compounds having HIV integrase inhibiting activities ��Ұ����ҩ��ʽ���� 2004-12-08 CN disclosed
WO-2004089896-A1 11β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed
EP-0509769-B1 Heterocyclic amides having HLE inhibiting activity ZENECA LTD (GB) 1996-09-11 EP disclosed
US-5521179-A Heterocyclic amides ZENECA LIMITED (GB) 1996-05-28 US disclosed
EP-0509769-A2 Heterocyclic amides having HLE inhibiting activity ZENECA LIMITED (GB) 1992-10-21 EP 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 (2 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-20100120743-A1 11Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HSD11B1, HSD3B1, HSD17B1 HPGD 42/4885POLB 846/4885SMN1; SMN2 2477/4885
US-20060089349-A1 11beta-hydroxysteroid dehydrogenase type 1 active compounds HSD11B1, HSD3B1, HSD17B1 HPGD 42/4885POLB 846/4885SMN1; SMN2 2477/4885

“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.