SCHEMBL11926349

SCHEMBL11926349

COCCN(C)c1cc(C(=O)Nc2nnc(C(C)(C)C)s2)nc(N2CCOCC2)n1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NAPEPLD Q6IQ20 2/20 0.46
▸ PIK3CA P42336 11/20 0.44
▸ PTGER3 P43115 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ POLQ O75417 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ BRAF P15056 1/20 0.37
▸ KCNQ3 O43525 1/20 0.36
▸ KCNQ2 O43526 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
SCHEMBL3118261 0.85 NAPEPLD (0.48) NAPEPLDPIK3CACNR2NPC1RAB9A
SCHEMBL11926341 0.81 NAPEPLD (0.47) NAPEPLDPIK3CACNR2BRAF
SCHEMBL3114927 0.81 NAPEPLD (0.46) NAPEPLDPIK3CA
SCHEMBL11926353 0.80 NAPEPLD (0.51) NAPEPLDPIK3CABRAF
SCHEMBL11926351 0.79 NAPEPLD (0.49) NAPEPLDPIK3CABRAF
SCHEMBL11926338 0.79 NAPEPLD (0.47) NAPEPLDPIK3CABRAF
SCHEMBL11926315 0.79 NAPEPLD (0.52) NAPEPLDPIK3CABRAF
SCHEMBL3106073 0.79 PIK3CA (0.62) NAPEPLDPIK3CA
SCHEMBL11926352 0.79 NAPEPLD (0.48) NAPEPLDPIK3CABRAFKCNQ3KCNQ2
SCHEMBL11926350 0.78 NAPEPLD (0.49) NAPEPLDPIK3CATSHRNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236795-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2012-08-07 — — US disclosed
US-8236795-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2012-08-07 — — US disclosed
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 — — US disclosed
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 — — US disclosed
US-7696202-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2010-04-13 — — 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-20100256132-A1 IL-12 MODULATORY COMPOUNDS IL2, IL4, IFNG NAPEPLD 1303/4885PIK3CA 2810/4885PTGER3 428/4885

“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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