SCHEMBL18590378

SCHEMBL18590378

COCCOCCOCCOc1cc(Cl)c(Cl)c(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ L3MBTL1 Q9Y468 7/20 0.37
▸ RECQL P46063 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ POLB P06746 2/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ ALDH2 P05091 1/20 0.33

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
SCHEMBL6375876 0.95 L3MBTL1 (0.36) KDM4ETDP1L3MBTL1MAPTALDH1A1
SCHEMBL25180363 0.80 MAPT (0.31) MAPTKMT2AMEN1
SCHEMBL16549482 0.76 ALDH1A1 (0.39) LMNARECQLSMN1; SMN2ALDH1A1POLB
SCHEMBL4364410 0.75 KDM4E (0.41) KDM4ETDP1L3MBTL1RECQLMAPT
SCHEMBL12299798 0.75 ALDH1A1 (0.48) KDM4ETDP1RECQLMAPTALDH1A1
SCHEMBL8257439 0.75 SLC6A4 (0.42) KDM4ETDP1LMNASMN1; SMN2ALDH1A1
SCHEMBL264987 0.74 ALDH1A1 (0.46) KDM4ELMNAL3MBTL1MAPTALDH1A1
SCHEMBL29466255 0.74 ALDH1A1 (0.46) KDM4ELMNAL3MBTL1MAPTALDH1A1
SCHEMBL14478367 0.73 POLB (0.40) KDM4ETDP1LMNAL3MBTL1MAPT
SCHEMBL22219086 0.73 ALDH1A1 (0.41) KDM4ETDP1LMNAL3MBTL1RECQL

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-20170066782-A1 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5-AMINE NEKTAR THERAPEUTICS 2017-03-09 — — 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-20170066782-A1 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5-AMINE KCNJ2, TRPC5, RYR2 KDM4E 1078/4885TDP1 163/4885LMNA 2114/4885

“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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