SCHEMBL3034263

SCHEMBL3034263

CC(C)CC1(C(=O)NCc2cccc(C(F)(F)F)c2)CCN(Cc2ccc3c(c2)OCO3)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.53
UBE2M P61081 1/20 0.49
DCUN1D1 Q96GG9 1/20 0.49
MCHR1 Q99705 3/20 0.49
MME P08473 1/20 0.47
KCNH2 Q12809 2/20 0.47
HTT P42858 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
CHRM3 P20309 5/20 0.46
LMNA P02545 2/20 0.46
TSHR P16473 1/20 0.46
POLB P06746 1/20 0.45
OPRL1 P41146 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
SCHEMBL3033257 0.92 ALDH1A1 (0.48) PPARGMCHR1MMEHTTKDM4E
SCHEMBL3033033 0.89 CYP3A4 (0.49) PPARGUBE2MDCUN1D1MCHR1MME
SCHEMBL13243602 0.89 ALDH1A1 (0.46) PPARGMCHR1MMEHTTKDM4E
SCHEMBL14222308 0.88 MAPT (0.56) PPARGUBE2MDCUN1D1KCNH2KDM4E
SCHEMBL3029012 0.83 LMNA (0.53) MCHR1MMEHTTKDM4EALDH1A1
SCHEMBL3033586 0.83 SMN1; SMN2 (0.47) KCNH2HTTALDH1A1
SCHEMBL3038625 0.82 ALDH1A1 (0.53) PPARGUBE2MDCUN1D1MCHR1ALDH1A1
SCHEMBL3028682 0.81 MCHR1 (0.49) MCHR1HTTKDM4EALDH1A1TDP1
SCHEMBL3028685 0.81 MCHR1 (0.49) MCHR1HTTKDM4EALDH1A1TDP1
SCHEMBL3030479 0.81 MCHR1 (0.49) MCHR1HTTKDM4EALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE EPIX DELAWARE, INC. (US) 2010-08-19 US claimed
US-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE EPIX DELAWARE, INC. (US) 2010-08-19 US disclosed
US-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE EPIX DELAWARE, INC. (US) 2010-08-19 US disclosed
US-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE EPIX DELAWARE, INC. (US) 2010-08-19 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-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE CCR2, CCR1, CCR5 PPARG 124/4885UBE2M 4733/4885DCUN1D1 3037/4885

“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.