SCHEMBL18177902

SCHEMBL18177902

OC(COc1ccc(Cl)cc1Cl)CN1CCN(Cc2ccccc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.73
CYP1A2 P05177 1/20 0.73
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
HTT P42858 2/20 0.64
USP2 O75604 1/20 0.64
NPSR1 Q6W5P4 2/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
LMNA P02545 2/20 0.62
GAA P10253 1/20 0.62
IDE P14735 1/20 0.62
XBP1 P17861 1/20 0.62
PAX8 Q06710 1/20 0.62
CACNA1G O43497 4/20 0.60
KCNH2 Q12809 2/20 0.60
ATM Q13315 1/20 0.60
ABCB1 P08183 8/20 0.59
ALDH1A1 P00352 3/20 0.58
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL9750911 0.85 KMT2A (0.81) CYP2D6CYP1A2MEN1KMT2ANPSR1
Hydrochloric Acid SCHEMBL9751034 0.85 KMT2A (0.80) CYP2D6CYP1A2MEN1KMT2ANPSR1
SCHEMBL13621747 0.83 CACNA1G (0.87) CYP2D6MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL7288789 0.81 CYP1A2 (0.79) CYP2D6CYP1A2MEN1KMT2AHTT
SCHEMBL11361956 0.80 CYP1A2 (0.72) CYP2D6CYP1A2MEN1KMT2AHTT
SCHEMBL9750861 0.80 KMT2A (0.72) CYP2D6CYP1A2MEN1KMT2ANPSR1
SCHEMBL25009884 0.80 CYP1A2 (0.75) CYP2D6CYP1A2MEN1KMT2AHTT
SCHEMBL15702583 0.77 ADRB2 (0.72) MEN1KMT2AHTTNPSR1GAA
SCHEMBL2505043 0.77 LMNA (0.98) CYP2D6CYP1A2MEN1KMT2AHTT
SCHEMBL8035809 0.76 SIGMAR1 (0.53) CYP2D6CYP1A2KMT2AHTTLMNA

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-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage WASE, NISHIKANT 2020-03-05 US disclosed
US-10351883-B2 Compounds for increasing lipid synthesis and storage NUTECH VENTURES (US) 2019-07-16 US disclosed
US-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage INVITROGEN CORPORATION 2016-10-27 US disclosed
US-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage INVITROGEN CORPORATION 2016-10-27 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 (3 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-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 CYP2D6 2399/4885CYP1A2 1503/4885MEN1 2824/4885
US-10351883-B2 Compounds for increasing lipid synthesis and storage FASN, LIPC, SREBF2 CYP2D6 2399/4885CYP1A2 1503/4885MEN1 2824/4885
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 CYP2D6 2399/4885CYP1A2 1503/4885MEN1 2824/4885

“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.