SCHEMBL739152

SCHEMBL739152

c1ccc(-c2ccc(-c3cc4c5c(cccc5n3)-c3ccccc3-4)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.49
TOP1 P11387 4/20 0.47
ACHE P22303 1/20 0.47
ACACA Q13085 2/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
MAPT P10636 2/20 0.45
APEX1 P27695 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
HPGD P15428 4/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
PDE10A Q9Y233 1/20 0.44
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 1/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
HIF1A Q16665 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL732138 0.96 TOP1 (0.50) DHODHTOP1ACHEACACAMEN1
SCHEMBL740550 0.91 MAPT (0.44) DHODHTOP1ACHEACACAMEN1
SCHEMBL732394 0.86 MEN1 (0.50) MEN1KMT2AMAPTAPEX1HPGD
SCHEMBL730507 0.86 TOP1 (0.52) DHODHTOP1MEN1KMT2AMAPT
SCHEMBL23095416 0.85 MAPT (0.56) DHODHTOP1ACHEACACAMEN1
SCHEMBL730175 0.83 CYP1A2 (0.49) MEN1KMT2AMAPTAPEX1SMN1; SMN2
SCHEMBL19237722 0.83 KDM4E (0.41) DHODHTOP1ACHEACACAMEN1
SCHEMBL731833 0.82 TNF (0.47) DHODHTOP1ACACAMEN1KMT2A
SCHEMBL732385 0.81 BIRC5 (0.46) MEN1KMT2AMAPTAPEX1SMN1; SMN2
SCHEMBL730315 0.81 KMT2A (0.49) ACHEMEN1KMT2AMAPTAPEX1

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 DHODH 2568/4885TOP1 1154/4885ACHE 377/4885

“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.