SCHEMBL5635529

SCHEMBL5635529

Cc1nc2c(N)cccn2c1CO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 7/20 0.56
ATP4B P51164 7/20 0.56
TSPO P30536 1/20 0.40
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK1 P28482 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 2/20 0.37
USP7 Q93009 1/20 0.35
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL28697302 0.83 ATP4A (0.58) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL5634105 0.82 ATP4A (0.57) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL5633236 0.81 ATP4A (0.60) ATP4AATP4BTSPOMEN1CYP1A2
SCHEMBL8374477 0.80 ATP4A (0.46) ATP4AATP4BTSPOMEN1CYP1A2
SCHEMBL9230991 0.80 ATP4A (0.50) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL5220990 0.78 ATP4A (0.51) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL8813632 0.76 ATP4A (0.41) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL9233398 0.75 ATP4A (0.40) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL10611088 0.75 ATP4A (0.50) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL8815230 0.75 KDM4E (0.43) ATP4AATP4BTSPOMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0930062-A1 Compositions containing imidazo-pyridine derivatives for dying keratinous fibres and process L'OREAL (FR) 1999-07-21 EP claimed
US-7196196-B2 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BASF AKTIENGESELLSCHAFT (DE) 2007-03-27 US disclosed
US-20050020620-A1 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BASF AKTIENGESELLSCHAFT (DE) 2005-01-27 US disclosed
US-5980585-A NONTOXIC; HAIR DYE L'OREAL (FR) 1999-11-09 US disclosed
EP-0930062-A1 Compositions containing imidazo-pyridine derivatives for dying keratinous fibres and process L'OREAL (FR) 1999-07-21 EP disclosed
WO-1988008843-A2 NEW IMIDAZOLS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1988-11-17 WO disclosed
EP-0290003-A2 Imidazoles Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1988-11-09 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 (1 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-20050020620-A1 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BTN3A1, DHPS, NISCH ATP4A 2872/4885ATP4B 2849/4885TSPO 2182/4885

“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.