SCHEMBL18177899

SCHEMBL18177899

Oc1ccc(CN2CCN(c3ccccc3Cl)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.64
ALDH1A1 P00352 1/20 0.64
PLA2G1B P04054 1/20 0.64
RAB9A P51151 1/20 0.64
ATG4B Q9Y4P1 1/20 0.64
DRD4 P21917 4/20 0.63
DRD2 P14416 4/20 0.63
DRD3 P35462 3/20 0.63
HTR7 P34969 1/20 0.58
ADRA1D P25100 1/20 0.51
ADRA1A P35348 1/20 0.51
ADRA1B P35368 1/20 0.51
LMNA P02545 1/20 0.50
MAPK1 P28482 1/20 0.50
HTR1A P08908 1/20 0.50

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
SCHEMBL6029899 0.87 SIGMAR1 (0.68) KDM4EALDH1A1PLA2G1BRAB9AATG4B
SCHEMBL6864941 0.86 DRD4 (0.81) KDM4EALDH1A1PLA2G1BRAB9AATG4B
SCHEMBL18177896 0.84 ATM (0.64) KDM4EALDH1A1DRD4DRD2HTR7
SCHEMBL11552675 0.84 ALDH1A1 (0.64) KDM4EALDH1A1PLA2G1BRAB9AATG4B
SCHEMBL9720681 0.81 MAPK1 (0.78) KDM4EALDH1A1DRD4DRD2DRD3
SCHEMBL10605688 0.81 KDM4E (0.56) KDM4EALDH1A1PLA2G1BRAB9AATG4B
SCHEMBL9720752 0.81 DRD4 (0.77) DRD4DRD2DRD3LMNA
SCHEMBL27371867 0.81 KDM4E (0.64) KDM4EALDH1A1PLA2G1BRAB9AATG4B
SCHEMBL5428090 0.80 DRD4 (0.63) KDM4EALDH1A1DRD4LMNA
SCHEMBL9720693 0.80 DRD4 (0.87) KDM4EALDH1A1DRD4DRD2DRD3

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 KDM4E 1755/4885ALDH1A1 1121/4885PLA2G1B 314/4885
US-10351883-B2 Compounds for increasing lipid synthesis and storage FASN, LIPC, SREBF2 KDM4E 1755/4885ALDH1A1 1121/4885PLA2G1B 314/4885
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 KDM4E 1755/4885ALDH1A1 1121/4885PLA2G1B 314/4885

“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.