SCHEMBL11947652

SCHEMBL11947652

CCCCNC(=O)OCC(N)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.50
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48
HDAC5 Q9UQL6 1/20 0.48
NCOR2 Q9Y618 1/20 0.48
HTT P42858 1/20 0.48
ACHE P22303 5/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.46
MMP2 P08253 1/20 0.46
CHRNB2 P17787 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
SCHEMBL11947655 0.92 POLB (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13018949 0.87 LMNA (0.46) RENHDAC3HDAC1HDAC2ACHE
SCHEMBL17045247 0.86 MMP2 (0.50) POLBMMP2
SCHEMBL11947649 0.86 MMP2 (0.50) POLBMMP2
SCHEMBL17045249 0.86 MMP2 (0.50) POLBMMP2
Hydrochloric Acid SCHEMBL9774131 0.83 CHRNB2 (0.47) RENHDAC3HDAC4HDAC1HDAC7
SCHEMBL30175773 0.82 MMP2 (0.49) HTTLMNAMMP2
SCHEMBL30175769 0.82 MMP2 (0.49) HTTLMNAMMP2
SCHEMBL11947656 0.81 MMP2 (0.51) HDAC3HDAC1HDAC2MMP2
SCHEMBL11947651 0.81 MMP2 (0.51) MMP2

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-8232315-B2 Methods for treating drug addiction and improving addiction-related behavior SK BIOPHARMACEUTICALS CO., LTD. (KR) 2012-07-31 US disclosed
US-20100331332-A1 METHODS FOR TREATING DRUG ADDICTION AND IMPROVING ADDICTION-RELATED BEHAVIOR SK HOLDINGS CO., LTD. (KR) 2010-12-30 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-20100331332-A1 METHODS FOR TREATING DRUG ADDICTION AND IMPROVING ADDICTION-RELATED BEHAVIOR CES2, SLC6A3, CHAT REN 1423/4885HDAC3 118/4885HDAC4 150/4885

“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.