SCHEMBL13065675

SCHEMBL13065675

Nc1cc(C(=O)Nc2ccc(-c3ccc(Br)cc3)cc2)cc(C(=O)Nc2ccc(-c3ccc(Br)cc3)cc2)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.63
▸ MEN1 O00255 5/20 0.54
▸ KMT2A Q03164 5/20 0.54
▸ ABCB1 P08183 1/20 0.52
▸ TDP1 Q9NUW8 2/20 0.51
▸ POLB P06746 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ APEX1 P27695 1/20 0.51
▸ SNCA P37840 1/20 0.51
▸ PTPN1 P18031 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ HDAC2 Q92769 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ CASP3 P42574 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ MAOB P27338 1/20 0.48

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
SCHEMBL13023110 0.86 TP53 (0.58) TP53MEN1KMT2AABCB1TDP1
SCHEMBL13065988 0.85 PTPN1 (0.66) MEN1KMT2ATDP1POLBLMNA
SCHEMBL13065669 0.84 PTPN1 (0.70) MEN1KMT2ATDP1POLBLMNA
SCHEMBL13065997 0.84 NPC1 (0.61) TP53MEN1KMT2ATDP1POLB
SCHEMBL10952359 0.83 MEN1 (0.74) TP53MEN1KMT2ATDP1POLB
SCHEMBL12540695 0.82 MEN1 (0.67) MEN1KMT2ATDP1POLBLMNA
SCHEMBL7235873 0.81 TP53 (0.78) TP53MEN1KMT2ANPC1RAB9A
SCHEMBL13065664 0.80 KCNH2 (0.53) MEN1KMT2ATDP1POLBLMNA
SCHEMBL27903409 0.80 KMT2A (0.81) TP53MEN1KMT2ATDP1POLB
SCHEMBL11576406 0.80 KMT2A (0.81) TP53MEN1KMT2ATDP1POLB

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-20100286353-A1 ACETYLENE COMPOUND, SALT THEREOF, CONDENSATE THEREOF, AND COMPOSITION THEREOF FUJIFILM CORPORATION (JP) 2010-11-11 — — 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-20100286353-A1 ACETYLENE COMPOUND, SALT THEREOF, CONDENSATE THEREOF, AND COMPOSITION THEREOF KAT8, HDAC10, SSRP1 TP53 3212/4885MEN1 379/4885KMT2A 583/4885

“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.

Send feedback