SCHEMBL732385

SCHEMBL732385

Brc1cccc(-c2cc3c4c(cccc4n2)-c2ccccc2-3)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAOB P27338 1/20 0.46
POLB P06746 2/20 0.45
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 5/20 0.44
HPGD P15428 2/20 0.44
RAB9A P51151 2/20 0.44
HK1 P19367 1/20 0.44
HKDC1 Q2TB90 1/20 0.44
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
APEX1 P27695 1/20 0.42
IDO1 P14902 1/20 0.41
METAP2 P50579 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 2/20 0.40

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 0.84 TOP1 (0.50) SMN1; SMN2ALDH1A1LMNAMAPTHPGD
SCHEMBL740550 0.83 MAPT (0.44) SMN1; SMN2ALDH1A1LMNAMAPTHPGD
SCHEMBL21382834 0.83 MAPT (0.41) BIRC5SMN1; SMN2MAOBPOLBALDH1A1
SCHEMBL739152 0.81 DHODH (0.49) SMN1; SMN2ALDH1A1LMNAMAPTHPGD
SCHEMBL730315 0.81 KMT2A (0.49) SMN1; SMN2ALDH1A1LMNAMAPTRAB9A
SCHEMBL730175 0.79 CYP1A2 (0.49) SMN1; SMN2MAOBALDH1A1MAPTHPGD
SCHEMBL16203121 0.79 ACACA (0.56) BIRC5SMN1; SMN2POLBALDH1A1LMNA
SCHEMBL21382858 0.77 ALDH1A1 (0.40) BIRC5SMN1; SMN2MAOBPOLBALDH1A1
SCHEMBL16203126 0.76 ACACA (0.54) BIRC5SMN1; SMN2POLBALDH1A1LMNA
SCHEMBL17953923 0.75 MAPT (0.49) ALDH1A1MAPTHPGDRAB9AHKDC1

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 6 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-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
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 BIRC5 1522/4885SMN1; SMN2 2871/4885MAOB 2490/4885

“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.