SCHEMBL18171334

SCHEMBL18171334

O=C(C1COc2ccccc2O1)N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AIMP2 Q13155 3/20 0.81
KMT2A Q03164 4/20 0.76
TSHR P16473 1/20 0.76
ALDH1A1 P00352 3/20 0.67
HPGD P15428 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
MAPK1 P28482 3/20 0.66
MAPT P10636 1/20 0.66
GAA P10253 1/20 0.65
NPC1 O15118 1/20 0.62
HTR1A P08908 1/20 0.60
SIGMAR1 Q99720 1/20 0.60
POLB P06746 3/20 0.59
LTA4H P09960 1/20 0.58
TDP1 Q9NUW8 1/20 0.57

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
Hydrochloric Acid SCHEMBL18171335 0.99 AIMP2 (0.80) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL3355450 0.91 KMT2A (0.73) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL25337487 0.90 AIMP2 (1.00) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL4136572 0.84 ALDH1A1 (0.78) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL7978591 0.84 KMT2A (0.75) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL8020110 0.81 HTR1A (0.61) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL3355413 0.81 AIMP2 (0.64) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL13202892 0.80 ALDH1A1 (0.76) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL10167539 0.80 ALDH1A1 (0.97) AIMP2KMT2ATSHRALDH1A1HPGD
SCHEMBL21213968 0.80 AIMP2 (0.58) AIMP2KMT2ATSHRALDH1A1HPGD

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 7 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-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-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
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 AIMP2 1976/4885KMT2A 2512/4885TSHR 4486/4885
US-10351883-B2 Compounds for increasing lipid synthesis and storage FASN, LIPC, SREBF2 AIMP2 1976/4885KMT2A 2512/4885TSHR 4486/4885
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 AIMP2 1976/4885KMT2A 2512/4885TSHR 4486/4885

“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.