SCHEMBL12377324

SCHEMBL12377324

CC(C)n1c(NCc2ccc(-c3ccccc3)cc2)nc2cc(C(F)(F)F)ccc21

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
GAA P10253 2/20 0.52
TSHR P16473 1/20 0.52
TRPC5 Q9UL62 2/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
EPHX2 P34913 1/20 0.43
ACP1 P24666 1/20 0.42
ALOX15 P16050 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.41
APP P05067 1/20 0.41
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
GFER P55789 1/20 0.40
RORC P51449 1/20 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
SCHEMBL12377299 0.93 MAPT (0.53) MAPTGAATSHRTRPC5ALDH1A1
SCHEMBL12412024 0.88 NPC1 (0.52) MAPTGAATRPC5LMNAEPHX2
SCHEMBL12377302 0.88 MAPT (0.49) MAPTGAATSHRTRPC5ALDH1A1
SCHEMBL12377304 0.87 MAPT (0.49) MAPTGAATSHRTRPC5ALDH1A1
SCHEMBL12377282 0.87 MAPT (0.48) MAPTGAATSHRTRPC5MEN1
SCHEMBL12377279 0.83 HSD17B10 (0.55) GAAALDH1A1LMNAACP1KMT2A
SCHEMBL12377300 0.83 MRGPRX1 (0.46) MAPTGAATSHRTRPC5ALDH1A1
SCHEMBL12377283 0.82 MAPT (0.42) MAPTGAATSHREPHX2ACP1
SCHEMBL12413898 0.80 NPC1 (0.53) GAATSHRTRPC5LMNAALOX15
SCHEMBL12377309 0.80 PRCP (0.43) RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989422-B2 Antibacterial agents ALCHEMIA LIMITED (AU) 2011-08-02 US disclosed
US-20090023669-A1 Antibacterial Agents ALCHEMIA LIMITED (AU) 2009-01-22 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-20090023669-A1 Antibacterial Agents MRPL21, FUT6, FUT5 MAPT 4853/4885GAA 132/4885TSHR 3443/4885

“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.