SCHEMBL20720741

SCHEMBL20720741

CNc1c2ccccc2nc2cc(OCC3CCCN(C)C3)c(OC)c(OC(=O)C(F)(F)F)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 4/20 0.40
▸ HDAC3 O15379 1/20 0.39
▸ APP P05067 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ EGFR P00533 3/20 0.39
▸ FGFR1 P11362 3/20 0.39
▸ FLT1 P17948 3/20 0.39
▸ FLT4 P35916 3/20 0.39
▸ KDR P35968 3/20 0.39
▸ RBP4 P02753 4/20 0.38
▸ TTR P02766 3/20 0.38
▸ EDNRA P25101 4/20 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
SCHEMBL20720750 0.95 HDAC3 (0.40) KITHDAC3APPACHEHDAC4
Trifluoroacetic Acid SCHEMBL20720740 0.82 KIT (0.49) KITEGFRFGFR1FLT1FLT4
SCHEMBL20720782 0.79 ACHE (0.42) HDAC3APPACHEHDAC4HDAC1
SCHEMBL20720716 0.78 EHMT2 (0.50) —
Trifluoroacetic Acid SCHEMBL20720749 0.77 KIT (0.47) KITEGFRFGFR1FLT1FLT4
SCHEMBL19260530 0.77 KIT (0.55) KITEGFRFGFR1FLT1FLT4
SCHEMBL20720682 0.75 EHMT2 (0.43) —
SCHEMBL20720729 0.74 EHMT2 (0.52) —
SCHEMBL20720751 0.74 CACNA2D1 (0.46) HDAC3APPACHEHDAC4HDAC1
SCHEMBL20720718 0.74 CACNA2D1 (0.46) HDAC3APPACHEHDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11254651-B2 Histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2022-02-22 — — US disclosed
EP-3416963-B1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2021-07-28 — — EP disclosed
US-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2019-02-14 — — 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 (2 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-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS EHMT1, EHMT2, BMI1 KIT 2717/4885HDAC3 139/4885APP 3783/4885
US-11254651-B2 Histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 KIT 2717/4885HDAC3 139/4885APP 3783/4885

“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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