SCHEMBL21474097

SCHEMBL21474097

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nearest known ligand 0.99

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.99
RCOR1 Q9UKL0 3/20 0.88
LDHB P07195 4/20 0.44
TERF2IP Q9NYB0 2/20 0.39
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
NPY1R P25929 1/20 0.36
NPY2R P49146 1/20 0.36
NPY4R P50391 1/20 0.36
NPY5R Q15761 1/20 0.36
JAK1 P23458 1/20 0.36
CTNNB1 P35222 1/20 0.36
STAT1 P42224 1/20 0.36
F11 P03951 2/20 0.36
KEAP1 Q14145 1/20 0.36
BECN1 Q14457 4/20 0.35

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
SCHEMBL25641510 1.00 KDM1A (0.99) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL29394303 1.00 KDM1A (0.99) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL14845813 1.00 KDM1A (0.99) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL31066574 0.99 KDM1A (1.00) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL21476977 0.99 KDM1A (1.00) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL49226 0.99 KDM1A (1.00) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL18902532 0.99 KDM1A (1.00) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL21476976 0.98 KDM1A (0.95) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL21474068 0.98 KDM1A (0.95) KDM1ARCOR1LDHBTERF2IPESR1
SCHEMBL14845493 0.98 KDM1A (0.95) KDM1ARCOR1LDHBTERF2IPESR1

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-20190315806-A1 POLYMYXIN DERIVATIVE, PREPARATION METHOD AND APPLICATION THEREOF INSTITUTE OF MEDICINAL BIOTECHNOLOGY, CAMS (CN) 2019-10-17 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-20190315806-A1 POLYMYXIN DERIVATIVE, PREPARATION METHOD AND APPLICATION THEREOF NPEPPS, MYD88, MRPL21 KDM1A 2143/4885RCOR1 1398/4885LDHB 2499/4885

“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.