SCHEMBL3620517

SCHEMBL3620517

CCC(C[N+]1(NC(=O)c2ccccc2OC)CCCCC1)OC(=O)c1ccccc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 1/20 0.43
▸ MAPT P10636 3/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HPGD P15428 3/20 0.39
▸ GAA P10253 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ STAT3 P40763 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ ATM Q13315 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ AHR P35869 1/20 0.39

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
SCHEMBL3521802 0.94 KMT2A (0.41) CTSDMAPTNPC1RAB9ATP53
SCHEMBL3515943 0.93 NPC1 (0.44) CTSDMAPTNPC1RAB9ATP53
SCHEMBL3521719 0.92 CTSD (0.43) CTSDMAPTNPC1RAB9ATP53
SCHEMBL3521477 0.89 CTSD (0.41) CTSDMAPTNPC1RAB9ATP53
SCHEMBL3516277 0.87 KMT2A (0.46) MAPTNPC1RAB9ATP53MAPK1
SCHEMBL3516887 0.84 CTSD (0.47) CTSDMAPTNPC1RAB9ATP53
SCHEMBL13115474 0.79 ATM (0.36) CTSDMAPTNPC1RAB9ATP53
SCHEMBL3615449 0.77 KMT2A (0.44) CTSDMAPTNPC1RAB9ATP53
SCHEMBL13135884 0.77 MEN1 (0.42) MAPTNPC1RAB9ATP53MAPK1
SCHEMBL15031355 0.74 CTSD (0.45) CTSDMAPTNPC1RAB9ATP53

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-8466238-B2 Latent curing agents, epoxy resin compositions containing the same, sealing materials, and organic EL displays MITSUI CHEMICALS, INC. (JP) 2013-06-18 — — US disclosed
US-20100253213-A1 LATENT CURING AGENTS, EPOXY RESIN COMPOSITIONS CONTAINING THE SAME, SEALING MATERIALS, AND ORGANIC EL DISPLAYS MITSUI CHEMICALS, INC (JP) 2010-10-07 — — 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-20100253213-A1 LATENT CURING AGENTS, EPOXY RESIN COMPOSITIONS CONTAINING THE SAME, SEALING MATERIALS, AND ORGANIC EL DISPLAYS LTA4H, EPHX2, EPHX1 CTSD 3637/4885MAPT 1418/4885NPC1 1783/4885

“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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