SCHEMBL3138573

SCHEMBL3138573

Cc1ccc(N2CCN(CC(=O)N3CCC(O)(c4cccc(C(F)(F)F)c4)CC3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
CYP3A4 P08684 2/20 0.53
CYP2D6 P10635 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
OPRM1 P35372 5/20 0.50
OPRL1 P41146 6/20 0.49
MAPT P10636 4/20 0.49
ALDH1A1 P00352 3/20 0.49
LMNA P02545 3/20 0.49
POLB P06746 2/20 0.48
KDM4E B2RXH2 2/20 0.47
GAA P10253 1/20 0.47
HTT P42858 1/20 0.47
OPRK1 P41145 1/20 0.47
CHRM4 P08173 1/20 0.47
ABCB11 O95342 1/20 0.46

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
SCHEMBL3127162 0.91 OPRM1 (0.53) MEN1KMT2ACYP3A4CYP2D6CYP1A2
SCHEMBL3131752 0.91 OPRM1 (0.48) MEN1KMT2ACYP3A4CYP2D6CYP1A2
SCHEMBL3140085 0.90 SMN1; SMN2 (0.55) MEN1KMT2ACYP3A4CYP2D6OPRM1
SCHEMBL3127147 0.90 MAPT (0.54) MEN1KMT2ACYP3A4CYP2D6CYP1A2
SCHEMBL3133328 0.90 ALDH1A1 (0.57) MEN1KMT2ANPSR1OPRM1OPRL1
Hydrochloric Acid SCHEMBL4853192 0.89 KDM4E (0.56) MEN1KMT2ACYP3A4CYP2D6CYP1A2
SCHEMBL3135594 0.87 OPRL1 (0.53) MEN1KMT2ACYP3A4CYP2D6NPSR1
SCHEMBL3135283 0.86 MEN1 (0.60) MEN1KMT2AOPRM1OPRL1MAPT
SCHEMBL3132053 0.86 TSHR (0.55) MEN1KMT2AOPRM1OPRL1MAPT
SCHEMBL4810067 0.83 OPRM1 (0.46) MEN1KMT2ACYP3A4CYP2D6NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1699778-B1 (4-PHENYLPIPERAZIN-1-YL)ACYLPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2010-07-14 EP disclosed
US-7423039-B2 (4-phenylpiperazin-1-yl)acylpiperidine derivatives, preparation thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2008-09-09 US disclosed
US-20070021609-A1 4-PHENYLPIPERAZIN-1-YL)ACYLPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2007-01-25 US disclosed
EP-1699778-A1 (4-PHENYLPIPERAZIN-1-YL)ACYLPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND APPLICATION OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2006-09-13 EP disclosed
WO-2005054227-A1 (4-PHENYLPIPERAZIN-1-YL)ACYLPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2005-06-16 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-20070021609-A1 4-PHENYLPIPERAZIN-1-YL)ACYLPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND APPLICATION OF SAME IN THERAPEUTICS AGPAT5, DNPEP, AGPAT2 MEN1 2655/4885KMT2A 826/4885CYP3A4 1484/4885

“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.