SCHEMBL2134437

SCHEMBL2134437

CCCC(F)CCCSC(CC(C)C)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.35
MAPT P10636 1/20 0.34
CHRM1 P11229 1/20 0.32
AKR1A1 P14550 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALOX5 P09917 1/20 0.32
PPARG P37231 1/20 0.32
EPHX1 P07099 1/20 0.32
RNPEP Q9H4A4 1/20 0.31
SLC7A5 Q01650 1/20 0.31
GRIK1 P39086 1/20 0.30

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
SCHEMBL2136393 0.89 FOLH1 (0.36) FOLH1MAPTALOX5PPARGRNPEP
SCHEMBL2134399 0.87 MAPT (0.38) FOLH1MAPTCHRM1AKR1A1CHRM3
SCHEMBL2136424 0.86 MAPT (0.37) FOLH1MAPTCHRM1AKR1A1CHRM3
SCHEMBL2132789 0.85 METAP2 (0.31) TDP1EPHX1
SCHEMBL2135453 0.85 CA1 (0.35) FOLH1EPHX1
SCHEMBL2134556 0.85 LMNA (0.32) EPHX1
SCHEMBL2138373 0.85 MAPT (0.34) FOLH1MAPTEPHX1RNPEPSLC7A5
SCHEMBL2135444 0.84 HSD17B10 (0.43) MAPTCHRM1AKR1A1CHRM3HTR2A
SCHEMBL2138747 0.84
SCHEMBL2137074 0.84 HDAC3 (0.33) HDAC1HDAC2

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-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-26 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-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER GRHPR, AKR7A2, FAR1 FOLH1 1822/4885MAPT 4195/4885CHRM1 761/4885

“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.