SCHEMBL2969857

SCHEMBL2969857

CNN(C(=O)O)C(CC=O)C1CCN(Cc2ccc(-c3ccc(F)cc3)cc2Cl)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.40
ALDH1A1 P00352 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
RECQL P46063 1/20 0.39
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
CXCR4 P61073 2/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MCHR1 Q99705 1/20 0.36
CXCR3 P49682 1/20 0.36
CHKA P35790 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PKM P14618 1/20 0.35

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
SCHEMBL2972297 0.91 ALDH1A1 (0.43) ACHEALDH1A1MCHR1CXCR3TDP1
SCHEMBL2982137 0.84 POLB (0.48) ALDH1A1DRD2DRD4CXCR4
SCHEMBL2982166 0.81 MCHR1 (0.45) MCHR1
SCHEMBL2970365 0.79 BCHE (0.45) ACHEALDH1A1MEN1KMT2A
SCHEMBL2970171 0.79 TEAD1 (0.45) ACHEMEN1KMT2A
Hydrochloric Acid SCHEMBL2971262 0.78 TEAD1 (0.44) ACHEMEN1KMT2A
SCHEMBL2975518 0.76 DRD2 (0.43) ALDH1A1DRD2
SCHEMBL2983169 0.76 CCR8 (0.50) ALDH1A1DRD2TDP1
SCHEMBL2972433 0.76 UBE2M (0.38) CYP2D6CYP2C19PKM
SCHEMBL3592324 0.76 ACHE (0.47) ACHEALDH1A1CYP2D6CYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781590-B2 Piperidinylalkylcarbamate derivatives, methods for their preparation and the therapeutic use thereof as fatty acid amido hydrolase enzyme inhibitors SANOFI-AVENTIS (FR) 2010-08-24 US disclosed
US-20070021403-A1 PIPERIDINYLALKYLCARBAMATE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THE THERAPEUTIC USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2007-01-25 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-20070021403-A1 PIPERIDINYLALKYLCARBAMATE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THE THERAPEUTIC USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, CNR2 ACHE 455/4885ALDH1A1 1076/4885CYP2D6 606/4885

“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.