SCHEMBL14899321

SCHEMBL14899321

CCCCC/C=C\CCCC(=O)OC(C)C

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.70
FAAH O00519 3/20 0.65
ALDH1A1 P00352 2/20 0.65
MAPT P10636 2/20 0.65
CNR1 P21554 2/20 0.65
HPGD P15428 1/20 0.65
CNR2 P34972 1/20 0.65
PRKCA P17252 2/20 0.56
PRKCE Q02156 1/20 0.56
PRKCQ Q04759 1/20 0.56
PRKCD Q05655 1/20 0.56
PGR P06401 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
ADRA2C P18825 1/20 0.55
SLC6A2 P23975 1/20 0.55
HTR2B P41595 1/20 0.55
MC3R P41968 1/20 0.55
SLC6A3 Q01959 1/20 0.55
PDE4D Q08499 1/20 0.55
SCN5A Q14524 1/20 0.55

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
SCHEMBL11051839 1.00 LMNA (0.70) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL3662637 0.95 CNR1 (0.73) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL3662634 0.95 CNR1 (0.73) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL10338452 0.95 LMNA (0.79) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL6514796 0.95 LMNA (0.79) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL6429415 0.95 LMNA (0.79) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL6514791 0.95 LMNA (0.79) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL18133442 0.95 LMNA (0.79) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL4124375 0.95 LMNA (0.79) LMNAFAAHALDH1A1MAPTCNR1
SCHEMBL61998 0.95 LMNA (0.79) LMNAFAAHALDH1A1MAPTCNR1

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-9580417-B2 Prodrugs of heteraromatic compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2017-02-28 US disclosed
US-20170015659-A1 Prodrugs of NH-Acidic Compounds JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2017-01-19 US disclosed
US-20160318869-A1 Heterocyclic Compounds for the Treatment of Neurological and Psychological Disorders JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2016-11-03 US disclosed
US-20160009713-A1 Prodrugs of Heteraromatic Compounds JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2016-01-14 US disclosed
US-20150274670-A1 Heterocyclic Compounds for the Treatment of Neurological and Psychological Disorders MORGAN STANLEY SENIOR FUNDING, INC. 2015-10-01 US disclosed
US-9102618-B2 Prodrugs of NH-acidic compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2015-08-11 US disclosed
US-8431576-B2 Heterocyclic compounds for the treatment of neurological and psychological disorders ALKERMES PHARMA IRELAND LIMITED (IE) 2013-04-30 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 (4 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-20160318869-A1 Heterocyclic Compounds for the Treatment of Neurological and Psychological Disorders GABBR1, GABBR2, GABRE LMNA 1349/4885FAAH 565/4885ALDH1A1 599/4885
US-20170015659-A1 Prodrugs of NH-Acidic Compounds SI, NAAA, NIT2 LMNA 2642/4885FAAH 203/4885ALDH1A1 1082/4885
US-20150274670-A1 Heterocyclic Compounds for the Treatment of Neurological and Psychological Disorders GABBR1, GABBR2, GABRE LMNA 1349/4885FAAH 565/4885ALDH1A1 599/4885
US-20160009713-A1 Prodrugs of Heteraromatic Compounds CYP2D6, CYP2B6, CYP3A4 LMNA 2731/4885FAAH 735/4885ALDH1A1 172/4885

“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.