SCHEMBL6501666

SCHEMBL6501666

Nc1cccc(-c2nn(C3CCCCO3)c3ccc(-c4n[nH]c(C(c5ccccc5)(c5ccccc5)c5ccccc5)n4)cc23)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 1/20 0.36
ATAD2 Q6PL18 1/20 0.36
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
FGFR1 P11362 1/20 0.32
DDR2 Q16832 1/20 0.32
ATR Q13535 1/20 0.31
CTSD P07339 1/20 0.31
AURKA O14965 1/20 0.31
USP30 Q70CQ3 1/20 0.31
DNMT3A Q9Y6K1 1/20 0.30
MCL1 Q07820 1/20 0.30

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
SCHEMBL5781711 0.87 FGFR1 (0.34) CPT1ARXRARXRBRXRGFGFR1
SCHEMBL5374181 0.81 DRD1 (0.33) RXRARXRBRXRGATRCTSD
SCHEMBL5382088 0.81 PDE8B (0.31) RXRARXRBRXRGATRCTSD
SCHEMBL4080401 0.80 HRH3 (0.36) FGFR1DNMT3A
SCHEMBL5377904 0.75 NPC1 (0.38) RXRARXRBRXRGATR
SCHEMBL5372749 0.75 IRAK4 (0.35) RXRARXRBRXRGATR
SCHEMBL6501668 0.73
SCHEMBL5373368 0.73 DRD1 (0.34) RXRARXRBRXRGATR
SCHEMBL5667992 0.73 ATR (0.33) RXRARXRBRXRGATRCTSD
SCHEMBL4605947 0.71 CMKLR1 (0.34) CPT1ARXRARXRBRXRGATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6897231-B2 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, INC. (US) 2005-05-24 US disclosed
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, LLC 2002-08-01 US 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-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 CPT1A 816/4885ATAD2 2746/4885RXRA 988/4885

“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.