SCHEMBL13311507

SCHEMBL13311507

Cc1cnc(Nc2ccc(F)c(Cl)c2)nc1N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 3/20 0.57
▸ JAK1 P23458 3/20 0.57
▸ TYK2 P29597 3/20 0.57
▸ JAK3 P52333 3/20 0.57
▸ NPC1 O15118 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.55
▸ AURKA O14965 2/20 0.54
▸ AURKB Q96GD4 2/20 0.54
▸ AXL P30530 3/20 0.53
▸ STK17A Q9UEE5 1/20 0.52
▸ TDO2 P48775 1/20 0.52
▸ SYK P43405 1/20 0.50
▸ CCNK O75909 1/20 0.50
▸ CCNA2 P20248 1/20 0.50
▸ CDK2 P24941 1/20 0.50
▸ CCND3 P30281 1/20 0.50
▸ CDK9 P50750 1/20 0.50
▸ CDK6 Q00534 1/20 0.50

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
SCHEMBL3344180 0.87 NPC1 (0.53) NPC1RAB9ASMN1; SMN2TDP1AURKA
SCHEMBL3350959 0.83 SMN1; SMN2 (0.55) JAK2NPC1RAB9ASMN1; SMN2AURKA
SCHEMBL13310863 0.83 NPC1 (0.49) NPC1RAB9ASMN1; SMN2TDP1AURKA
SCHEMBL3450597 0.83 TDO2 (0.52) NPC1RAB9ASMN1; SMN2TDP1AURKA
SCHEMBL3456615 0.81 NPC1 (0.56) JAK2NPC1RAB9ASMN1; SMN2TDP1
SCHEMBL13312654 0.79 PAK1 (0.46) JAK2JAK1TYK2JAK3NPC1
SCHEMBL3451371 0.78 FGFR1 (0.45) JAK2JAK1TYK2JAK3NPC1
SCHEMBL3449190 0.78 NPC1 (0.52) JAK2JAK3NPC1RAB9ASMN1; SMN2
SCHEMBL18330249 0.78 TDP1 (0.73) JAK3SMN1; SMN2TDP1AURKAAURKB
SCHEMBL3451632 0.77 TDO2 (0.47) JAK2JAK1TYK2JAK3NPC1

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 1 patent. 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

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 JAK2 1093/4885JAK1 2067/4885TYK2 2617/4885

“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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