SCHEMBL6796728

SCHEMBL6796728

COc1ccc(CCCNC(=O)/C(=C/OC(F)F)c2ccc(C)cc2)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
THRB P10828 1/20 0.53
MAPT P10636 3/20 0.51
ADRB2 P07550 1/20 0.48
ADRB1 P08588 1/20 0.48
ADRB3 P13945 1/20 0.48
LMNA P02545 3/20 0.48
PLAAT3 P53816 1/20 0.47
PLAAT5 Q96KN8 1/20 0.47
PLAAT2 Q9NWW9 1/20 0.47
PLAAT4 Q9UL19 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 1/20 0.45
PKM P14618 1/20 0.45

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
SCHEMBL6796731 1.00 ALDH1A1 (0.54) ALDH1A1THRBMAPTADRB2ADRB1
SCHEMBL6796855 0.94 ALDH1A1 (0.62) ALDH1A1THRBMAPTADRB2ADRB1
SCHEMBL6796850 0.94 ALDH1A1 (0.62) ALDH1A1THRBMAPTADRB2ADRB1
SCHEMBL6797880 0.86 ALDH1A1 (0.52) ALDH1A1THRBMAPTLMNAKMT2A
SCHEMBL6797885 0.86 ALDH1A1 (0.52) ALDH1A1THRBMAPTLMNAKMT2A
SCHEMBL6801543 0.86 MAPT (0.58) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL6801546 0.86 MAPT (0.58) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL6802468 0.85 ALDH1A1 (0.61) ALDH1A1THRBMAPTADRB2ADRB1
SCHEMBL6802471 0.85 ALDH1A1 (0.61) ALDH1A1THRBMAPTADRB2ADRB1
SCHEMBL6801944 0.85 ALDH1A1 (0.58) ALDH1A1THRBMAPTSMN1; SMN2

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-6762321-B2 SUCH AS N-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-3-DIFLUOROMETHOXY-2-(4 -METHYLPHENYL)ACRYLAMIDE; FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-07-13 US disclosed
US-20030195354-A1 Amide compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-10-16 US disclosed
EP-1295868-A1 AMIDE COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-26 EP 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-20030195354-A1 Amide compounds and use thereof CBR1, CBR3, NAT1 ALDH1A1 244/4885THRB 3020/4885MAPT 3676/4885

“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.