SCHEMBL3521477

SCHEMBL3521477

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

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 1/20 0.41
▸ MAPT P10636 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ TP53 P04637 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HCN1 O60741 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HPGD P15428 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ HCN4 Q9Y3Q4 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ AHR P35869 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ STAT3 P40763 1/20 0.37

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
SCHEMBL3521719 0.89 CTSD (0.43) CTSDMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL3620517 0.89 CTSD (0.43) CTSDMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL3519120 0.87 TP53 (0.43) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL3515943 0.86 NPC1 (0.44) CTSDMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL3521802 0.85 KMT2A (0.41) CTSDMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL3516277 0.84 KMT2A (0.46) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL3516887 0.82 CTSD (0.47) CTSDMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL13115467 0.80 ELANE (0.33) CTSDMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL3615449 0.75 KMT2A (0.44) CTSDMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL13135884 0.75 MEN1 (0.42) MAPTSMN1; SMN2NPC1RAB9ATP53

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-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-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
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
EP-2199313-A1 LATENT CURING AGENTS, EPOXY RESIN COMPOSITIONS CONATING THE SAME, SEALING MATERIALS, AND ORGANIC EL DISPLAYS Mitsui Chemicals, Inc. (JP) 2010-06-23 — — EP 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 1418/4885SMN1; SMN2 2719/4885

“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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