SCHEMBL21335210

SCHEMBL21335210

CC(C)C[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)C2CCNCC2)C(C)O)CCNC(=O)[C@H]([C@H](C)O)NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC1=O

nearest known ligand 0.83

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.83
RCOR1 Q9UKL0 2/20 0.83
LDHB P07195 3/20 0.46
TERF2IP Q9NYB0 7/20 0.43
SSTR5 P35346 6/20 0.42
SSTR2 P30874 4/20 0.42
SSTR4 P31391 4/20 0.42
SSTR1 P30872 2/20 0.41
SSTR3 P32745 2/20 0.41
EGFR P00533 1/20 0.41
LCK P06239 1/20 0.41

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
SCHEMBL17992399 1.00 KDM1A (0.83) KDM1ARCOR1LDHBTERF2IPSSTR5
SCHEMBL21335211 1.00 KDM1A (0.83) KDM1ARCOR1LDHBTERF2IPSSTR5
SCHEMBL21335125 0.97 KDM1A (0.83) KDM1ARCOR1LDHBTERF2IPSSTR5
SCHEMBL17992335 0.97 KDM1A (0.83) KDM1ARCOR1LDHBTERF2IPSSTR5
SCHEMBL21335122 0.96 KDM1A (0.79) KDM1ARCOR1LDHBTERF2IPSSTR5
SCHEMBL17992382 0.96 KDM1A (0.79) KDM1ARCOR1LDHBTERF2IPSSTR5
SCHEMBL17992319 0.95 KDM1A (0.81) KDM1ARCOR1LDHBTERF2IPSSTR5
SCHEMBL21335248 0.95 KDM1A (0.81) KDM1ARCOR1LDHBTERF2IPSSTR5
SCHEMBL22105959 0.92 KDM1A (0.70) KDM1ARCOR1LDHBSSTR5SSTR2
SCHEMBL21335159 0.92 KDM1A (0.79) KDM1ARCOR1LDHBTERF2IPSSTR5

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 1566/4885LDHB 2456/4885

“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.