SCHEMBL3378721

SCHEMBL3378721

CCCCCNc1ncc(Br)c(O)n1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KCNH3 Q9ULD8 2/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ DNM2 P50570 3/20 0.41
▸ TYRO3 Q06418 9/20 0.41
▸ MERTK Q12866 9/20 0.41
▸ FLT3 P36888 8/20 0.41
▸ GAS6 Q14393 8/20 0.41
▸ AXL P30530 4/20 0.41
▸ HCAR3 P49019 1/20 0.38
▸ GPR84 Q9NQS5 1/20 0.38
▸ ABL1 P00519 1/20 0.37
▸ HRH4 Q9H3N8 1/20 0.36

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
SCHEMBL3457103 0.81 KMT2A (0.44) KCNH3KMT2ADNM2TYRO3MERTK
SCHEMBL11002056 0.80 KMT2A (0.43) KCNH3KMT2ADNM2TYRO3MERTK
SCHEMBL10998571 0.80 KMT2A (0.43) KCNH3KMT2ADNM2TYRO3MERTK
SCHEMBL3455242 0.79 ULK1 (0.41) KCNH3KMT2ADNM2TYRO3MERTK
SCHEMBL11081631 0.78 HCAR3 (0.48) KCNH3TYRO3MERTKFLT3GAS6
SCHEMBL11082898 0.77 HCAR3 (0.47) TYRO3MERTKFLT3GAS6AXL
SCHEMBL11081740 0.77 HCAR3 (0.47) TYRO3MERTKFLT3GAS6AXL
SCHEMBL10996367 0.76 TLR8 (0.43) KMT2ATYRO3MERTKFLT3GAS6
SCHEMBL10503228 0.75 DNM2 (0.44) KCNH3KMT2ADNM2TYRO3MERTK
SCHEMBL10531678 0.75 DNM2 (0.44) KCNH3KMT2ADNM2TYRO3MERTK

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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 — — US disclosed
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 — — 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 (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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD KCNH3 2586/4885KMT2A 4408/4885DNM2 2200/4885

“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.

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