SCHEMBL18890871

SCHEMBL18890871

O=C(Nc1ccccc1)c1ccc2c(c1)N(Cc1c(Cl)cccc1Cl)CCS2

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 16/20 0.73
▸ SMN1; SMN2 Q16637 7/20 0.64
▸ TP53 P04637 4/20 0.64
▸ KDM4E B2RXH2 6/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ NPC1 O15118 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ PPARG P37231 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ NR2E3 Q9Y5X4 1/20 0.54
▸ NCOR2 Q9Y618 1/20 0.54
▸ GFER P55789 4/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ GLA P06280 1/20 0.53

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
SCHEMBL18890873 0.81 MAPT (0.65) MAPTSMN1; SMN2TP53ALDH1A1KMT2A
SCHEMBL23769038 0.74 MAPT (0.74) MAPTSMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL21905570 0.72 MAPT (0.68) MAPTSMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL4515866 0.70 HPGD (0.51) MAPTSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL21972114 0.69 MAPT (1.00) MAPTSMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL23769051 0.69 MAPT (0.64) MAPTSMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL29978899 0.69 MAPT (0.64) MAPTSMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL30016367 0.68 CPT1A (1.00) MAPTKDM4ENPC1MAPK1PPARG
SCHEMBL751881 0.68 CPT1A (1.00) MAPTKDM4ENPC1MAPK1PPARG
SCHEMBL25037402 0.68 STING1 (0.50) MAPTKDM4EALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170146519-A1 STING AGONISTS AND METHODS OF SELECTING STING AGONISTS OREGON HEALTH & SCIENCE UNIVERSITY (US) 2017-05-25 — — 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-20170146519-A1 STING AGONISTS AND METHODS OF SELECTING STING AGONISTS STING1, IRF3, MAVS MAPT 4720/4885SMN1; SMN2 3692/4885TP53 286/4885

“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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