SCHEMBL12377310

SCHEMBL12377310

CC(C)n1c(NC(=O)CC(N)c2ccc(-c3ccccc3)cc2)nc2cc(C(F)(F)F)cc(Cl)c21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 9/20 0.41
SLC1A2 P43004 9/20 0.41
SLC1A1 P43005 9/20 0.41
TACR1 P25103 1/20 0.37
CASR P41180 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ACLY P53396 2/20 0.36
LDHB P07195 1/20 0.35
P2RX7 Q99572 1/20 0.35
PRCP P42785 2/20 0.35

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
SCHEMBL12413913 0.90 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1TACR1CASR
SCHEMBL12377293 0.87 PRCP (0.38) SLC1A3SLC1A2SLC1A1CASRACLY
SCHEMBL12377294 0.85 SLC1A3 (0.45) SLC1A3SLC1A2SLC1A1TACR1KDM4E
SCHEMBL12377303 0.83 PRCP (0.47) SLC1A3SLC1A2SLC1A1PRCP
SCHEMBL12413915 0.79 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1TACR1KDM4E
SCHEMBL12377297 0.77 HSD17B10 (0.43) NPC1RAB9ASMN1; SMN2
SCHEMBL12377283 0.77 MAPT (0.42) NPC1RAB9ASMN1; SMN2P2RX7
SCHEMBL12377291 0.72 MET (0.43) NPC1ALDH1A1RAB9ASMN1; SMN2P2RX7
SCHEMBL12377308 0.71 SPHK1 (0.36) KDM4EALDH1A1SMN1; SMN2
SCHEMBL12377301 0.71 PPARG (0.39) SLC1A3SLC1A2SLC1A1

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 SLC1A3 4080/4885SLC1A2 4042/4885SLC1A1 3291/4885

“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.