SCHEMBL5099986

SCHEMBL5099986

Cc1ccc(-c2ccc(F)c(C)c2)c(NC(=O)OC(=O)C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.38
RAB9A P51151 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
KDR P35968 6/20 0.36
FLT3 P36888 4/20 0.36
KIT P10721 3/20 0.36
ROCK2 O75116 1/20 0.35
MAP4K4 O95819 1/20 0.35
LCK P06239 1/20 0.35
CDK1 P06493 1/20 0.35
FLT1 P17948 1/20 0.35
AXL P30530 1/20 0.35
FLT4 P35916 1/20 0.35
FRK P42685 1/20 0.35
CLK2 P49760 1/20 0.35
BLK P51451 1/20 0.35
CSNK1G2 P78368 1/20 0.35
ITK Q08881 1/20 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
SCHEMBL5105754 0.92 CHRM3 (0.38) MAPTPTGS2IDH2
SCHEMBL5103918 0.91 FABP4 (0.39) SMN1; SMN2ALDH1A1LMNATSHRIDH2
SCHEMBL5103241 0.91 CHRM3 (0.38) HPGDSMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL5103689 0.88 CHRM3 (0.43) RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL5103245 0.87 HPGD (0.43) HPGDRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5113768 0.86 KMT2A (0.42) HPGDRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5099439 0.85 CHRM3 (0.45)
Trifluoroacetic Acid SCHEMBL5099983 0.84 RAB9A (0.39) RAB9ASMN1; SMN2NPC1MAPTKDR
SCHEMBL5099275 0.84 IDH2 (0.41) HPGDALDH1A1LMNAIDH2
SCHEMBL5113235 0.83 CHRM3 (0.45) IDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists LAINE DRAMANE I 2008-10-09 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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists CHRM3, CHRNG, CHRM2 HPGD 1575/4885RAB9A 2952/4885SMN1; SMN2 2627/4885

“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.