SCHEMBL3976438

SCHEMBL3976438

CC(C)(C)OC(=O)N1CCN(C(=O)C(c2cccc(F)c2)C2(O)CCCCC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.47
GPR119 Q8TDV5 2/20 0.42
PDK2 Q15119 1/20 0.41
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP3A5 P20815 1/20 0.39
TP53 P04637 1/20 0.39
S1PR2 O95136 1/20 0.39
MAPT P10636 1/20 0.39
HPGDS O60760 1/20 0.39
CCNT1 O60563 1/20 0.38
GRM5 P41594 1/20 0.38
GRM1 Q13255 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
SCHEMBL3975455 0.97 SLC6A2 (0.43) SLC6A2GPR119PDK2ATMMEN1
SCHEMBL3980411 0.88 SLC6A2 (0.47) SLC6A2MEN1KMT2ACYP3A4CYP3A5
SCHEMBL3980468 0.88 MEN1 (0.40) GPR119PDK2ATMMEN1KMT2A
SCHEMBL3972164 0.88 SLC6A2 (0.47) SLC6A2MEN1KMT2ACYP3A4CYP3A5
SCHEMBL3961635 0.88 SLC6A2 (0.47) SLC6A2MEN1KMT2ACYP3A4CYP3A5
SCHEMBL3960128 0.88 MEN1 (0.40) GPR119PDK2ATMMEN1KMT2A
SCHEMBL3970062 0.88 SLC6A2 (0.47) SLC6A2MEN1KMT2ACYP3A4CYP3A5
SCHEMBL4260651 0.88 MEN1 (0.40) GPR119PDK2ATMMEN1KMT2A
SCHEMBL3971604 0.88 SLC6A2 (0.47) SLC6A2MEN1KMT2ACYP3A4CYP3A5
SCHEMBL3979294 0.87 S1PR2 (0.43) SLC6A2PDK2ATMMEN1KMT2A

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-7531543-B2 Phenylpiperazine cycloalkanol derivatives and methods of their use WYETH (US) 2009-05-12 US disclosed
EP-1673358-A1 PHENYLPIPERAZINE CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE Wyeth (US) 2006-06-28 EP disclosed
US-20050143394-A1 Phenylpiperazine cycloalkanol derivatives and methods of their use WYETH (US) 2005-06-30 US disclosed
WO-2005037808-A1 PHENYLPIPERAZINE CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2005-04-28 WO 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-20050143394-A1 Phenylpiperazine cycloalkanol derivatives and methods of their use HTR5A, PNMT, HTR3A SLC6A2 49/4885GPR119 90/4885PDK2 332/4885

“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.