SCHEMBL6741190

SCHEMBL6741190

COC(=O)/C(=C\c1ccc(Br)cc1)CBr

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
MAPT P10636 2/20 0.51
LMNA P02545 2/20 0.51
MEN1 O00255 2/20 0.51
S1PR4 O95977 1/20 0.51
S1PR1 P21453 1/20 0.51
MAPK1 P28482 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
PTGS2 P35354 2/20 0.43
HPGD P15428 3/20 0.41
GSK3B P49841 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
NPC1 O15118 1/20 0.37
RECQL P46063 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 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
SCHEMBL6740629 1.00 KMT2A (0.51) KMT2AMAPTLMNAMEN1S1PR4
SCHEMBL6740625 1.00 KMT2A (0.51) KMT2AMAPTLMNAMEN1S1PR4
SCHEMBL30973302 0.87 KMT2A (0.51) KMT2AMAPTLMNAMEN1S1PR4
SCHEMBL20048294 0.85 GRIK1 (0.43) PTGS2HPGDGSK3B
SCHEMBL6299379 0.85 RECQL (0.53) KMT2AMAPTMEN1NPC1RECQL
SCHEMBL6299383 0.85 RECQL (0.53) KMT2AMAPTMEN1NPC1RECQL
SCHEMBL6299382 0.85 RECQL (0.53) KMT2AMAPTMEN1NPC1RECQL
SCHEMBL6734561 0.84 ALDH1A1 (0.53) KMT2AMAPTLMNAMEN1MAPK1
SCHEMBL6734564 0.84 ALDH1A1 (0.53) KMT2AMAPTLMNAMEN1MAPK1
SCHEMBL6734560 0.84 ALDH1A1 (0.53) KMT2AMAPTLMNAMEN1MAPK1

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-6686503-B2 SPLITITNG FROM SOLID SUPPORT; METHYLATION ORTHO-MCNEIL PHARMACEUTICAL, INC. 2004-02-03 US disclosed
US-20010041345-A1 Methods for the synthesis of highly substituted 2,4-dioxopiperidine libraries CHAI WENYING (US) 2001-11-15 US disclosed
US-6288235-B1 MULTISTAGE REACTION WITH AMIDATION, CLEAVAGE FROM RESIN SUPPORT AND METHYLATION THEN CONDENSATION OF METHYL ESTER TO GIVE 2,4-DIOXOPIPERIDINE COMPOUNDS ORTHO-MCNEIL PHARMACEUTICAL, INC. 2001-09-11 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-20010041345-A1 Methods for the synthesis of highly substituted 2,4-dioxopiperidine libraries DHPS, DRD4, DRD2 KMT2A 2681/4885MAPT 4263/4885LMNA 4100/4885

“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.