SCHEMBL7069866

SCHEMBL7069866

CCC[C@H](C(N)=O)[C@@H](CC(C)C)C(=O)N1CCN(c2ccc(C)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
AKR1C3 P42330 1/20 0.43
LMNA P02545 4/20 0.41
MAPT P10636 4/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.40
GAA P10253 3/20 0.40
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
GFER P55789 1/20 0.40
TSHR P16473 1/20 0.39
SYK P43405 1/20 0.38

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
SCHEMBL7069863 1.00 POLB (0.45) POLBAKR1C3LMNAMAPTALDH1A1
SCHEMBL7068679 0.90 CHIA (0.48) AKR1C3LMNAALDH1A1HPGDHTT
SCHEMBL7068676 0.90 CHIA (0.48) AKR1C3LMNAALDH1A1HPGDHTT
SCHEMBL7068690 0.90 ALDH1A1 (0.46) POLBAKR1C3LMNAMAPTALDH1A1
SCHEMBL7068688 0.90 ALDH1A1 (0.46) POLBAKR1C3LMNAMAPTALDH1A1
SCHEMBL7087657 0.89 GAA (0.51) POLBLMNAMAPTALDH1A1CYP2C9
SCHEMBL7087655 0.89 GAA (0.51) POLBLMNAMAPTALDH1A1CYP2C9
SCHEMBL7065717 0.88 CA12 (0.48) AKR1C3HTT
SCHEMBL7068799 0.88 MAPT (0.46) POLBLMNAMAPTALDH1A1HTT
SCHEMBL7065713 0.88 CA12 (0.48) AKR1C3HTT

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-20030232985-A1 Succinoylamino heterocycles as inhibitors of a beta protein production THOMPSON LORIN A (US) 2003-12-18 US disclosed
US-20030073701-A1 Succinoylamino heterocycles as inhibitors of a beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-04-17 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 (2 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-20030073701-A1 Succinoylamino heterocycles as inhibitors of a beta protein production APP, BACE1, APH1A POLB 2847/4885AKR1C3 3166/4885LMNA 911/4885
US-20030232985-A1 Succinoylamino heterocycles as inhibitors of a beta protein production APP, BACE1, APH1A POLB 2847/4885AKR1C3 3166/4885LMNA 911/4885

“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.