SCHEMBL12796908

SCHEMBL12796908

Fc1cccc(F)c1CNc1cnc2c(n1)CCCc1ccc(-n3ccnc3)cc1-2

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ STIM1 Q13586 2/20 0.41
▸ ORAI1 Q96D31 2/20 0.41
▸ CD38 P28907 3/20 0.33
▸ CYP19A1 P11511 2/20 0.33
▸ CYP11B1 P15538 2/20 0.33
▸ CYP11B2 P19099 2/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33
▸ CRBN Q96SW2 1/20 0.32
▸ CCNT1 O60563 1/20 0.32
▸ CDK9 P50750 1/20 0.32
▸ PDE3B Q13370 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ EED O75530 1/20 0.32
▸ SUZ12 Q15022 1/20 0.32
▸ EZH2 Q15910 1/20 0.32
▸ ADH5 P11766 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ PCSK9 Q8NBP7 1/20 0.31

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
SCHEMBL12797006 0.83 NPC1 (0.38) CD38ADH5
SCHEMBL12796745 0.71 NPC1 (0.46) —
SCHEMBL12796898 0.69 IL2 (0.36) —
SCHEMBL12796909 0.69 GPR142 (0.37) MAOAMAOB
SCHEMBL12796918 0.67 STIM1 (0.35) STIM1ORAI1CD38CCNT1CDK9
SCHEMBL12848563 0.67 ADH5 (0.36) CD38CRBNADH5
SCHEMBL12848581 0.63 KDM4E (0.37) CRBNADH5
SCHEMBL12848953 0.63 ADORA2B (0.44) CYP11B1CYP11B2
SCHEMBL12848757 0.62 MEN1 (0.43) —
SCHEMBL12848916 0.61 CD38 (0.36) CD38CRBNPDE3BPDE3AADH5

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 3 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
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 STIM1 294/4885ORAI1 1397/4885CD38 583/4885

“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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