SCHEMBL4970657

SCHEMBL4970657

CCOC(=O)CCc1ccc(-c2cccc(CN(C)C(=O)CCc3cccc(OC)c3)c2)c(OCCCC(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.42
LMNA P02545 1/20 0.41
PTPN1 P18031 1/20 0.41
SYK P43405 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
RORC P51449 1/20 0.39
HSD17B2 P37059 3/20 0.39
AKR1C3 P42330 2/20 0.38
CHEK1 O14757 1/20 0.38
FFAR1 O14842 2/20 0.37
AKR1C2 P52895 1/20 0.37
TSPO P30536 1/20 0.36

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
SCHEMBL4969418 0.91 FFAR1 (0.45) KCNH2LMNAMEN1ALDH1A1KMT2A
SCHEMBL4972590 0.88 PPARA (0.43) KCNH2LMNAMEN1ALDH1A1KMT2A
SCHEMBL2086110 0.84 KCNH2 (0.44) KCNH2LMNAPTPN1SYKALDH1A1
SCHEMBL4970602 0.81 FFAR1 (0.43) KCNH2FFAR1
SCHEMBL5508217 0.81 MEN1 (0.40) LMNASYKMEN1ALDH1A1KMT2A
SCHEMBL4971865 0.79 FFAR1 (0.56) FFAR1
SCHEMBL4968600 0.79 FFAR1 (0.50) LMNAMEN1ALDH1A1KMT2AHSD17B2
SCHEMBL4970094 0.79 FFAR1 (0.42) FFAR1
SCHEMBL4969393 0.78 AKR1C3 (0.41) KCNH2PTPN1KMT2AAKR1C3FFAR1
SCHEMBL4967970 0.78 AKR1C3 (0.40) KCNH2PTPN1AKR1C3FFAR1

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
EP-1781274-B1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE RECEPTORS OF PPAR TYPE AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2008-11-05 EP claimed
US-20070207175-A1 Biaromatic compound activators of PPARgamma receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-09-06 US claimed
US-20070207175-A1 Biaromatic compound activators of PPARgamma receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-09-06 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-20070207175-A1 Biaromatic compound activators of PPARgamma receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARA, PPARD KCNH2 4097/4885LMNA 2446/4885PTPN1 1201/4885

“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.