SCHEMBL25040276

SCHEMBL25040276

Cc1ccc(F)c2cc(C(=O)Nc3cccc4cccnc34)ccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.71
▸ NPC1 O15118 2/20 0.71
▸ CASP3 P42574 1/20 0.71
▸ SENP8 Q96LD8 1/20 0.71
▸ SENP7 Q9BQF6 1/20 0.71
▸ SENP6 Q9GZR1 1/20 0.71
▸ MAPT P10636 5/20 0.67
▸ TP53 P04637 2/20 0.67
▸ KMT2A Q03164 4/20 0.60
▸ MEN1 O00255 3/20 0.60
▸ L3MBTL1 Q9Y468 2/20 0.60
▸ LMNA P02545 2/20 0.60
▸ HTT P42858 2/20 0.60
▸ KDR P35968 4/20 0.59
▸ GAA P10253 2/20 0.59
▸ HDAC6 Q9UBN7 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.56
▸ CNR2 P34972 1/20 0.56
▸ KDM4E B2RXH2 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54

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
SCHEMBL26099783 0.82 NPC1 (0.60) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL29509867 0.78 RAB9A (1.00) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL19748416 0.78 RAB9A (1.00) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL19422867 0.78 KDR (0.72) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL29911021 0.78 KDR (0.72) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL16456332 0.77 HDAC6 (0.77) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL17552183 0.77 HDAC6 (0.77) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL29911198 0.77 HDAC6 (0.77) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL29655132 0.77 HDAC6 (0.77) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL24430048 0.77 KDR (0.67) RAB9ANPC1CASP3SENP8SENP7

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-20230049113-A1 METHODS OF TREATING WHSC1-OVEREXPRESSING CANCERS BY INHIBITING SETD2 Epizyme, Inc. 2023-02-16 — — 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-20230049113-A1 METHODS OF TREATING WHSC1-OVEREXPRESSING CANCERS BY INHIBITING SETD2 NSD1, NSD3, EHMT1 RAB9A 3283/4885NPC1 1987/4885CASP3 2257/4885

“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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