SCHEMBL3399088

SCHEMBL3399088

O=C(O)[C@H](Cc1c[nH]c2ccccc12)NN1CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.62
ACE P12821 3/20 0.61
SMN1; SMN2 Q16637 1/20 0.60
KDM4E B2RXH2 2/20 0.59
MAPT P10636 2/20 0.59
APAF1 O14727 1/20 0.59
POLB P06746 1/20 0.59
RECQL P46063 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
MEN1 O00255 1/20 0.59
LMNA P02545 1/20 0.59
MPO P05164 1/20 0.59
TSHR P16473 1/20 0.59
BLM P54132 1/20 0.59
PMP22 Q01453 1/20 0.59
KMT2A Q03164 1/20 0.59
HIF1A Q16665 1/20 0.59
ITGB2 P05107 4/20 0.59
ICAM1 P05362 4/20 0.59
ITGAL P20701 4/20 0.59

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
SCHEMBL3399085 1.00 ALOX15 (0.62) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL30782236 0.85 ALOX15 (0.70) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL170878 0.83 KDM4E (0.69) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL2167226 0.83 ALOX15 (0.68) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL170877 0.83 KDM4E (0.69) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL1755294 0.83 ALOX15 (0.68) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL29791658 0.83 LTA4H (0.67) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL7297775 0.83 DNMT1 (0.65) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL1131418 0.82 ALOX15 (0.67) ALOX15ACESMN1; SMN2KDM4EMAPT
SCHEMBL991035 0.82 KDM4E (0.68) ALOX15ACESMN1; SMN2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240191212-A1 Nucleic Acid Molecules Encoding Indoleamine 2,3-Dioxygenase-2 LANKENAU INST MEDICAL RES (US) 2024-06-13 US disclosed
US-RE49708-E1 Nucleic acid molecules encoding indoleamine 2,3-dioxygenase-2 LANKENAU INSTITUTE FOR MEDICAL RESEARCH (US) 2023-10-24 US disclosed
US-8476454-B2 IDO inhibitors and methods of use LANKENAU INSTITUTE FOR MEDICAL RESEARCH (US) 2013-07-02 US disclosed
US-20100233166-A1 NOVEL IDO INHIBITORS AND METHODS OF USE PRENDERGAST GEORGE C 2010-09-16 US disclosed
US-7714139-B2 IDO inhibitors and methods of use LANKENAU INSTITUTE FOR MEDCIAL RESEARCH (US) 2010-05-11 US disclosed
EP-1606285-A4 NOVEL IDO INHIBITORS AND METHODS OF USE LANKENAU INST MEDICAL RES (US) 2009-03-18 EP disclosed
US-20070173524-A1 \"Novel ido inhibitors and methods of use LANKENAU INSTITUTE FOR MEDICAL RESEARCH 2007-07-26 US disclosed
EP-1606285-A1 NOVEL IDO INHIBITORS AND METHODS OF USE Lankenau Institute for Medical Research (US) 2005-12-21 EP disclosed
WO-2004094409-A1 NOVEL IDO INHIBITORS AND METHODS OF USE LANKENAU INSTITUTE FOR MEDICAL RESEARCH (US) 2004-11-04 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 (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-20070173524-A1 \"Novel ido inhibitors and methods of use IDO1, IDO2, INMT ALOX15 855/4885ACE 1793/4885SMN1; SMN2 2948/4885
US-20100233166-A1 NOVEL IDO INHIBITORS AND METHODS OF USE IDO1, IDO2, INMT ALOX15 771/4885ACE 2304/4885SMN1; SMN2 3706/4885

“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.