SCHEMBL11954751

SCHEMBL11954751

CNC(=O)OCC(N)Cc1ccc(OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.50
SLC6A4 P31645 1/20 0.49
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
GLA P06280 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 1/20 0.45
ANPEP P15144 1/20 0.44
ERAP2 Q6P179 1/20 0.44
SAE1 Q9UBE0 1/20 0.43
UBA2 Q9UBT2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.43
EPHX2 P34913 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL17045217 0.86 ACACB (0.47)
SCHEMBL17045215 0.86 ACACB (0.47)
SCHEMBL17045216 0.86 ACACB (0.47)
SCHEMBL11947639 0.85 ATM (0.41) CYP1A2KMT2AANPEPSMN1; SMN2
SCHEMBL17045270 0.85 ATM (0.41) CYP1A2KMT2AANPEPSMN1; SMN2
SCHEMBL17045267 0.85 ATM (0.41) CYP1A2KMT2AANPEPSMN1; SMN2
SCHEMBL17045271 0.84 SLC6A4 (0.51) SLC6A4CYP1A2CYP2D6CYP2C19KMT2A
SCHEMBL17045272 0.84 SLC6A4 (0.51) SLC6A4CYP1A2CYP2D6CYP2C19KMT2A
SCHEMBL17045234 0.84 TSHR (0.42) CYP1A2KMT2ASMN1; SMN2EPHX2ALDH1A1
SCHEMBL17045269 0.84 SLC6A4 (0.51) SLC6A4CYP1A2CYP2D6CYP2C19KMT2A

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-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
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 LDHA 2450/4885SLC6A4 64/4885CYP1A2 3069/4885

“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.