SCHEMBL5495007

SCHEMBL5495007

Cn1ncc(NC(=O)N[C@H]2CCN(C(=O)O)C2)c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.40
EPHX2 P34913 7/20 0.40
KDM5A P29375 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
KDM4E B2RXH2 1/20 0.38
TSHR P16473 1/20 0.37
USP30 Q70CQ3 1/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSS P25774 1/20 0.37
CTSC P53634 1/20 0.37
EPHX1 P07099 1/20 0.37

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
SCHEMBL6427739 1.00 TRPV1 (0.40) TRPV1EPHX2KDM5AKDM5BTRPM8
SCHEMBL5500964 0.89 USP30 (0.51) USP30EPHX1
SCHEMBL5499584 0.86 HDAC1 (0.39) KDM4ETSHRUSP30
SCHEMBL5497058 0.86 HDAC1 (0.39) KDM4ETSHRUSP30
SCHEMBL5496605 0.86 HDAC1 (0.39) KDM4ETSHRUSP30
SCHEMBL5493786 0.83 USP30 (0.42) TRPV1USP30
SCHEMBL27620821 0.82 HDAC3 (0.49) USP30
SCHEMBL6430075 0.82 HDAC3 (0.49) USP30
SCHEMBL5493346 0.80 HDAC1 (0.35) TRPV1KDM4E
SCHEMBL5500438 0.80 KMT2A (0.33) KDM4E

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
EP-1556389-B9 CEPHEM COMPOUNDS ASTELLAS PHARMA INC (JP) 2015-09-09 EP disclosed
EP-1556389-B3 CEPHEM COMPOUNDS ASTELLAS PHARMA INC (JP) 2015-04-01 EP disclosed
EP-1556389-B1 CEPHEM COMPOUNDS ASTELLAS PHARMA INC (JP) 2007-07-25 EP disclosed
US-20070037786-A1 Cephem compounds WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2007-02-15 US disclosed
US-7129232-B2 For therapy of of infectious diseases ASTELLAS PHARMA INC. (JP) 2006-10-31 US disclosed
US-20040132994-A1 Cephem compounds FUJISAWA PHARMACEUTICAL CO., LTD (JP) 2004-07-08 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 (2 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-20070037786-A1 Cephem compounds CEP170, ABCB11, SLC7A1 TRPV1 2277/4885EPHX2 455/4885KDM5A 3843/4885
US-20040132994-A1 Cephem compounds CEP170, ABCB11, RCC2 TRPV1 2527/4885EPHX2 369/4885KDM5A 3523/4885

“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.