SCHEMBL5517427

SCHEMBL5517427

CC(CC(C)(C)C)c1ccccc1NC(=O)c1ccccc1C(F)F

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.44
LMNA P02545 3/20 0.44
ALDH1A1 P00352 3/20 0.42
PKM P14618 2/20 0.40
KCNK3 O14649 2/20 0.40
KCNK9 Q9NPC2 2/20 0.40
CFTR P13569 1/20 0.39
MAPT P10636 3/20 0.39
MAPK1 P28482 2/20 0.39
RXFP1 Q9HBX9 2/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL14176574 0.87 DHODH (0.38) GAALMNAALDH1A1PKMCFTR
SCHEMBL14423097 0.87 SLC16A3 (0.49) GAALMNAALDH1A1MAPTMAPK1
SCHEMBL272686 0.87 KMT2A (0.47) GAALMNAALDH1A1PKMCFTR
SCHEMBL272581 0.86 SMN1; SMN2 (0.49) GAALMNAKCNK3KCNK9MAPT
SCHEMBL4831516 0.86 SMN1; SMN2 (0.51) GAALMNAALDH1A1RXFP1KMT2A
SCHEMBL4827248 0.86 HPGD (0.56) LMNAALDH1A1RXFP1NPC1HTT
SCHEMBL14523918 0.84 LMNA (0.45) GAALMNAALDH1A1PKMCFTR
SCHEMBL274896 0.83 ATM (0.43)
SCHEMBL5985534 0.82 MDM4 (0.50) GAALMNAALDH1A1KCNK3KCNK9
SCHEMBL13295653 0.81 ATM (0.44) GAALMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070082877-A1 Difluoromethylbenzanilides and use thereof for combating micro-organisms, intermediate products and use thereof BAYER CORPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-04-12 US disclosed
US-20070082877-A1 Difluoromethylbenzanilides and use thereof for combating micro-organisms, intermediate products and use thereof BAYER CORPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-04-12 US disclosed
US-20070082877-A1 Difluoromethylbenzanilides and use thereof for combating micro-organisms, intermediate products and use thereof BAYER CORPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-04-12 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-20070082877-A1 Difluoromethylbenzanilides and use thereof for combating micro-organisms, intermediate products and use thereof FBL, Q6ZSR9, DDT GAA 466/4885LMNA 4195/4885ALDH1A1 380/4885

“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.