SCHEMBL12848563

SCHEMBL12848563

O=C(Nc1c(F)cccc1F)c1nc2c(s1)-c1cc(-n3ccnc3)ccc1CCC2

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADH5 P11766 1/20 0.36
CD38 P28907 4/20 0.35
ABL1 P00519 1/20 0.35
MAPT P10636 1/20 0.34
ROCK2 O75116 6/20 0.34
CRBN Q96SW2 1/20 0.34
HDAC1 Q13547 1/20 0.34
CYP3A4 P08684 1/20 0.33
TAOK1 Q7L7X3 1/20 0.33
TAOK3 Q9H2K8 1/20 0.33
CSF1R P07333 1/20 0.33
GLS O94925 1/20 0.33

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
SCHEMBL12848916 0.93 CD38 (0.36) ADH5CD38ROCK2CRBNHDAC1
SCHEMBL12848744 0.92 ADH5 (0.36) ADH5CD38ROCK2CRBNHDAC1
SCHEMBL12848915 0.90 MAPT (0.36) MAPT
SCHEMBL12848750 0.90 CD38 (0.34) ADH5CD38ROCK2CRBNHDAC1
SCHEMBL12848747 0.90 CD38 (0.38) ADH5CD38CRBNTAOK1TAOK3
SCHEMBL12848746 0.88 TNIK (0.37) ADH5CD38CRBNHDAC1CSF1R
SCHEMBL12848470 0.87 CASP6 (0.32) ADH5CD38MAPTCRBN
SCHEMBL12848462 0.87 NPC1 (0.40) ADH5CD38HDAC1CYP3A4CSF1R
SCHEMBL12848565 0.87 CSF1R (0.37) ADH5CD38ABL1CRBNHDAC1
SCHEMBL12848748 0.85 ABL1 (0.38) ABL1MAPT

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-20110052643-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2011-03-03 US disclosed
WO-2009089305-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2009-07-16 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-20110052643-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES TSLP, NFATC1, IL5 ADH5 3303/4885CD38 583/4885ABL1 2326/4885

“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.