SCHEMBL9928814

SCHEMBL9928814

C(=Cc1ccccc1C=Cc1ccncc1)c1ccncc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
KDM4E B2RXH2 2/20 0.53
HSD17B10 Q99714 1/20 0.53
LMNA P02545 1/20 0.53
NPC1 O15118 4/20 0.50
GFER P55789 1/20 0.50
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
CYP1A2 P05177 2/20 0.48
MEN1 O00255 1/20 0.48
ALOX15 P16050 1/20 0.48
CASP1 P29466 1/20 0.48
HBB P68871 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48
CYP2C19 P33261 1/20 0.48
CYP11B2 P19099 2/20 0.46

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
SCHEMBL30268526 0.89 MAPT (0.50) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL24668282 0.89 MAPT (0.50) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL2173027 0.85 MAPT (0.46) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL6949589 0.85 MAPT (0.52) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL16915459 0.85 TRPA1 (0.70) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL2174903 0.85 MAPT (0.46) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL16915462 0.85 TRPA1 (0.70) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL11470409 0.85 CHAT (0.58) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL11470411 0.85 CHAT (0.58) MAPTKDM4EHSD17B10LMNANPC1
SCHEMBL30639253 0.85 MAPT (0.46) MAPTKDM4EHSD17B10LMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324784-A Cadmium complex in Fe3+Application in fluorescence detection 黄山学院 2024-07-12 CN claimed
CN-118165287-A Three-dimensional cadmium coordination polymer and preparation method thereof 黄山学院 2024-06-11 CN claimed
CN-118324784-A Cadmium complex in Fe3+Application in fluorescence detection 黄山学院 2024-07-12 CN disclosed
CN-118324784-A Cadmium complex in Fe3+Application in fluorescence detection 黄山学院 2024-07-12 CN disclosed
CN-118165287-A Three-dimensional cadmium coordination polymer and preparation method thereof 黄山学院 2024-06-11 CN disclosed
CN-118165287-A Three-dimensional cadmium coordination polymer and preparation method thereof 黄山学院 2024-06-11 CN disclosed
US-20140194605-A1 SERS Reporter Molecules and Methods CABOT SECURITY MATERIALS, INC. (US) 2014-07-10 US disclosed
US-20120156491-A1 SERS Reporter Molecules and Methods CABOT SECURITY MATERIALS INC. (US) 2012-06-21 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 (2 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-20140194605-A1 SERS Reporter Molecules and Methods SRRT, MYCBP, SPR MAPT 2191/4885KDM4E 3497/4885HSD17B10 1889/4885
US-20120156491-A1 SERS Reporter Molecules and Methods SRRT, MYCBP, SPR MAPT 2191/4885KDM4E 3497/4885HSD17B10 1889/4885

“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.