SCHEMBL9831760

SCHEMBL9831760

C#CC(=O)NCCCCCC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 1/20 0.63
▸ ADRA1A P35348 1/20 0.59
▸ CYP1A2 P05177 2/20 0.52
▸ CYP2C9 P11712 2/20 0.52
▸ CYP2C19 P33261 2/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ LMNA P02545 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ PMP22 Q01453 1/20 0.50
▸ EPHX2 P34913 6/20 0.49
▸ PLA2G2A P14555 1/20 0.49
▸ EPHX1 P07099 1/20 0.45
▸ PLA2G4A P47712 1/20 0.44

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
SCHEMBL20138624 0.91 PRMT1 (0.50) PRMT1ADRA1ACYP1A2CYP2C9CYP2C19
SCHEMBL20725190 0.85 ECE1 (0.45) PRMT1ADRA1ACYP1A2CYP2C9CYP2C19
SCHEMBL8995201 0.79 PRMT1 (0.68) PRMT1ADRA1ACYP1A2CYP2C9CYP2C19
SCHEMBL4746485 0.78 TDP1 (0.46) MAPK1EPHX2EPHX1
SCHEMBL10045225 0.78 CA3 (0.47) PRMT1MAPK1EPHX1
SCHEMBL2804471 0.78 PRMT1 (1.00) PRMT1ADRA1AMAPK1LMNATSHR
SCHEMBL6065930 0.78 PRMT1 (0.74) PRMT1ADRA1ACYP1A2CYP2C9CYP2C19
SCHEMBL11127968 0.78 PRMT1 (0.74) PRMT1ADRA1ACYP1A2CYP2C9CYP2C19
SCHEMBL17087514 0.78 PRMT1 (0.74) PRMT1ADRA1ACYP1A2CYP2C9CYP2C19
SCHEMBL2808479 0.78 PRMT1 (0.74) PRMT1ADRA1ACYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9856285-B2 Reagents for universal site-specific labeling and modifications of nucleic acids KAOHSIUNG MEDICAL UNIVERSITY (TW) 2018-01-02 — — US disclosed
US-20160272669-A1 NOVEL REAGENTS FOR UNIVERSAL SITE-SPECIFIC LABELING AND MODIFICATIONS OF NUCLEIC ACIDS KAOHSIUNG MEDICAL UNIVERSITY (TW) 2016-09-22 — — US disclosed
US-20160272669-A1 NOVEL REAGENTS FOR UNIVERSAL SITE-SPECIFIC LABELING AND MODIFICATIONS OF NUCLEIC ACIDS KAOHSIUNG MEDICAL UNIVERSITY (TW) 2016-09-22 — — US disclosed
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 — — EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 — — US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 — — EP 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-20160272669-A1 NOVEL REAGENTS FOR UNIVERSAL SITE-SPECIFIC LABELING AND MODIFICATIONS OF NUCLEIC ACIDS RNGTT, PNKP, ADAR PRMT1 3038/4885ADRA1A 4734/4885CYP1A2 4756/4885

“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.

Send feedback