SCHEMBL740550

SCHEMBL740550

c1ccc(-c2cccc(-c3cc4c5c(cccc5n3)-c3ccccc3-4)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
APEX1 P27695 1/20 0.44
KMT2A Q03164 1/20 0.44
TOP1 P11387 5/20 0.42
ACHE P22303 1/20 0.42
DHODH Q02127 1/20 0.41
ACACA Q13085 2/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
AKR1C1 Q04828 1/20 0.40
HPGD P15428 3/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PDE10A Q9Y233 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMO O15229 1/20 0.38

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
SCHEMBL739152 0.91 DHODH (0.49) MAPTMEN1APEX1KMT2ATOP1
SCHEMBL732138 0.91 TOP1 (0.50) MAPTMEN1APEX1KMT2ATOP1
SCHEMBL730315 0.83 KMT2A (0.49) MAPTMEN1APEX1KMT2AACHE
SCHEMBL732385 0.83 BIRC5 (0.46) MAPTMEN1APEX1KMT2AHPGD
SCHEMBL18503963 0.81 ACACA (0.52) MAPTTOP1ACHEDHODHACACA
SCHEMBL730175 0.81 CYP1A2 (0.49) MAPTMEN1APEX1KMT2AHPGD
SCHEMBL23095416 0.80 MAPT (0.56) MAPTMEN1APEX1KMT2ATOP1
SCHEMBL18504011 0.80 ACACA (0.51) MAPTTOP1ACHEDHODHACACA
SCHEMBL18503953 0.79 ACACA (0.60) MAPTMEN1KMT2ATOP1ACHE
SCHEMBL18503975 0.79 ACACA (0.56) MAPTTOP1ACHEDHODHACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8136974-B2 Metal coordination compound and light-emitting material containing the same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2012-03-20 US disclosed
US-8136974-B2 Metal coordination compound and light-emitting material containing the same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2012-03-20 US disclosed
US-20100317858-A1 METAL COORDINATION COMPOUND AND LIGHT-EMITTING MATERIAL CONTAINING THE SAME NATIONAL INSTITUTE OF ADVANCE INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-12-16 US disclosed
US-20100317858-A1 METAL COORDINATION COMPOUND AND LIGHT-EMITTING MATERIAL CONTAINING THE SAME NATIONAL INSTITUTE OF ADVANCE INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-12-16 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-20100317858-A1 METAL COORDINATION COMPOUND AND LIGHT-EMITTING MATERIAL CONTAINING THE SAME CRY1, SOD1, L1CAM MAPT 2289/4885MEN1 678/4885APEX1 638/4885

“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.