SCHEMBL21335115

SCHEMBL21335115

CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)CC(N)C2CCCCC2)C(C)O)CCNC(=O)C(C(C)O)NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC1=O

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.70
RCOR1 Q9UKL0 3/20 0.66
TERF2 Q15554 6/20 0.39
LDHB P07195 3/20 0.38
KEAP1 Q14145 3/20 0.36
TERF2IP Q9NYB0 2/20 0.35
NPY1R P25929 1/20 0.35
NPY2R P49146 1/20 0.35
NPY4R P50391 1/20 0.35
NPY5R Q15761 1/20 0.35
SSTR2 P30874 1/20 0.34
SSTR4 P31391 1/20 0.34
SSTR5 P35346 1/20 0.34

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
SCHEMBL17992357 1.00 KDM1A (0.70) KDM1ARCOR1TERF2LDHBKEAP1
SCHEMBL17992334 0.99 KDM1A (0.69) KDM1ARCOR1TERF2LDHBKEAP1
SCHEMBL14971405 0.94 KDM1A (0.76) KDM1ARCOR1TERF2KEAP1TERF2IP
SCHEMBL21335300 0.94 KDM1A (0.76) KDM1ARCOR1TERF2KEAP1TERF2IP
SCHEMBL22106077 0.94 KDM1A (0.76) KDM1ARCOR1TERF2KEAP1TERF2IP
SCHEMBL21335299 0.92 KDM1A (0.76) KDM1ARCOR1TERF2LDHBTERF2IP
SCHEMBL17992390 0.92 KDM1A (0.80) KDM1ARCOR1TERF2LDHBTERF2IP
SCHEMBL21335174 0.91 KDM1A (0.74) KDM1ARCOR1TERF2LDHBKEAP1
SCHEMBL17992290 0.91 KDM1A (0.74) KDM1ARCOR1TERF2LDHBKEAP1
SCHEMBL22105951 0.91 KDM1A (0.74) KDM1ARCOR1TERF2LDHBKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10407467-B2 Polymyxin derivatives and their use in combination therapy together with different antibiotics NEW PHARMA LICENCE HOLDINGS LIMITED (MT) 2019-09-10 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 (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-10407467-B2 Polymyxin derivatives and their use in combination therapy together with different antibiotics MRPS18A, MRPL21, RRP1B KDM1A 3699/4885RCOR1 1566/4885TERF2 2676/4885

“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.