SCHEMBL66137

SCHEMBL66137

Nc1nc2nc[c]nc2c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 8/20 0.49
THRB P10828 2/20 0.47
MITF O75030 1/20 0.47
TP53 P04637 1/20 0.47
ALOX15 P16050 1/20 0.47
HBB P68871 1/20 0.47
HIF1A Q16665 1/20 0.47
AKR1B1 P15121 1/20 0.45
PNP P00491 2/20 0.45
HSD17B10 Q99714 3/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
GLA P06280 1/20 0.44
PMP22 Q01453 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44

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
Pterine SCHEMBL64320 0.74 AKR1B1 (0.54) NOS1THRBMITFTP53ALOX15
Pterine SCHEMBL29364680 0.74 AKR1B1 (0.54) NOS1THRBMITFTP53ALOX15
SCHEMBL30503663 0.74 THRB (0.49) NOS1THRBMITFTP53ALOX15
Pterine SCHEMBL30474634 0.73 AKR1B1 (0.53) NOS1THRBMITFTP53ALOX15
Pterine SCHEMBL31190985 0.73 AKR1B1 (0.53) NOS1THRBMITFTP53ALOX15
Pterine SCHEMBL31296557 0.73 AKR1B1 (0.53) NOS1THRBMITFTP53ALOX15
Pterine SCHEMBL452642 0.73 AKR1B1 (0.53) NOS1THRBMITFTP53ALOX15
Pterine SCHEMBL906054 0.73 AKR1B1 (0.53) NOS1THRBMITFTP53ALOX15
Pterine SCHEMBL5703596 0.73 AKR1B1 (0.53) NOS1THRBMITFTP53ALOX15
Pterine SCHEMBL27566961 0.73 AKR1B1 (0.53) NOS1THRBMITFTP53ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043688-B2 Nickel catalysts with two alkali ions for homopolymerization and copolymerization UNIVERSITY OF HOUSTON SYSTEM (US) 2024-07-23 US disclosed
US-12043689-B2 Nickel catalysts with single metal cations for homopolymerization and copolymerization UNIVERSITY OF HOUSTON SYSTEM (US) 2024-07-23 US disclosed
EP-4374928-A2 NOVEL ALK2 INHIBITORS AND METHODS FOR INHIBITING BMP SIGNALING The Brigham And Women's Hospital Inc. (US) 2024-05-29 EP disclosed
US-20240166775-A1 NICKEL CATALYSTS WITH TWO METAL CATIONS FOR HOMOPOLYMERIZATION AND COPOLYMERIZATION UNIVERSITY OF HOUSTON SYSTEM (US) 2024-05-23 US disclosed
WO-2024097972-A2 COMPOUNDS AND METHODS FOR TREATING CANCERS CEDARS-SINAI MEDICAL CENTER (US) 2024-05-10 WO disclosed
EP-3484474-B1 PHENOTHIAZINE COMPOUNDS FOR THE TREATMENT OF RIBOSOMAL DISORDERS AND RIBOSOMOPATHIES CHILDRENS MEDICAL CT CORP (US) 2024-05-08 EP disclosed
US-20240117076-A1 NICKEL CATALYSTS WITH SINGLE METAL CATIONS FOR HOMOPOLYMERIZATION AND COPOLYMERIZATION UNIVERSITY OF HOUSTON SYSTEM (US) 2024-04-11 US disclosed
US-11944625-B2 Calmodulin inhibitors, Chk2 inhibitors and RSK inhibitors for the treatment of ribosomal disorders and ribosomapathies THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2024-04-02 US disclosed
US-20240101727-A1 NICKEL CATALYSTS WITH TWO ALKALI IONS FOR HOMOPOLYMERIZATION AND COPOLYMERIZATION UNIVERSITY OF HOUSTON SYSTEM (US) 2024-03-28 US disclosed
US-20240101726-A1 NICKEL CATALYSTS WITH SINGLE ALKALI IONS FOR HOMOPOLYMERIZATION AND COPOLYMERIZATION UNIVERSITY OF HOUSTON SYSTEM (US) 2024-03-28 US disclosed
US-20040014796-A1 Novel compounds and compositions as cathepsin S inhititors AXYS PHARMACEUTICALS, INC. 2004-01-22 US disclosed
WO-2004000838-A1 PEPTIDIC COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-12-31 WO disclosed
US-20030199506-A1 Novel compounds and compositions as cathepsin S inhibitors AXYS PHARMACEUTICALS INC. 2003-10-23 US disclosed
WO-2003042197-A1 OLIGOPEPTIDES AND COMPOSITIONS CONTAINING THEM AS CATHEPSIN S INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2003-05-22 WO disclosed
WO-2003024924-A1 NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2003-03-27 WO disclosed
WO-2002098406-A1 NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2002-12-12 WO disclosed
US-6492362-B1 Compounds and compositions as cathepsin S inhibitors AXYS PHARMACEUTICALS, INC. 2002-12-10 US disclosed
WO-2002051983-A2 NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2002-07-04 WO disclosed
EP-1212302-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2002-06-12 EP disclosed
WO-2001019796-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2001-03-22 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 (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-11944625-B2 Calmodulin inhibitors, Chk2 inhibitors and RSK inhibitors for the treatment of ribosomal disorders and ribosomapathies RPS6KA1, RPS6KA2, RPS6KA6 NOS1 4242/4885THRB 1994/4885MITF 1281/4885
US-20030199506-A1 Novel compounds and compositions as cathepsin S inhibitors CTSS, CTSB, CTSE NOS1 839/4885THRB 4400/4885MITF 2262/4885
US-20040014796-A1 Novel compounds and compositions as cathepsin S inhititors CTSS, CTSB, CTSE NOS1 1265/4885THRB 4252/4885MITF 1658/4885

“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.