SCHEMBL17882227

SCHEMBL17882227

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

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.79
▸ RCOR1 Q9UKL0 2/20 0.79
▸ SSTR5 P35346 7/20 0.41
▸ SSTR4 P31391 6/20 0.41
▸ SSTR2 P30874 5/20 0.41
▸ KEAP1 Q14145 1/20 0.39
▸ EGFR P00533 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ TERF2IP Q9NYB0 2/20 0.38
▸ LDHB P07195 1/20 0.38
▸ NPY1R P25929 1/20 0.38
▸ NPY2R P49146 1/20 0.38
▸ NPY4R P50391 1/20 0.38
▸ NPY5R Q15761 1/20 0.38

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
SCHEMBL19386908 0.92 KDM1A (0.74) KDM1ARCOR1SSTR5SSTR4SSTR2
SCHEMBL17882202 0.92 KDM1A (0.74) KDM1ARCOR1SSTR5SSTR4SSTR2
SCHEMBL17882196 0.92 KDM1A (0.74) KDM1ARCOR1SSTR5SSTR4SSTR2
SCHEMBL19386891 0.92 KDM1A (0.74) KDM1ARCOR1SSTR5SSTR4SSTR2
Desfa-[Dab1]Polymyxin B SCHEMBL29354296 0.91 KDM1A (0.86) KDM1ARCOR1SSTR5SSTR4SSTR2
SCHEMBL17882200 0.91 KDM1A (0.78) KDM1ARCOR1SSTR5SSTR4SSTR2
SCHEMBL19386890 0.91 KDM1A (0.78) KDM1ARCOR1SSTR5SSTR4SSTR2
SCHEMBL29692248 0.91 KDM1A (0.83) KDM1ARCOR1SSTR5SSTR4SSTR2
SCHEMBL19982014 0.91 KDM1A (0.83) KDM1ARCOR1SSTR5SSTR4SSTR2
SCHEMBL17882036 0.90 KDM1A (0.72) KDM1ARCOR1SSTR5SSTR4SSTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9771394-B2 Antimicrobial polymyxins for treatment of bacterial infections MICURX PHARMACEUTICALS, INC. (KY) 2017-09-26 — — US disclosed
US-20160185823-A1 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. 2016-06-30 — — 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 (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-20160185823-A1 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS VIP, AQP1, PEF1 KDM1A 4119/4885RCOR1 4858/4885SSTR5 1545/4885

“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.

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