SCHEMBL14927103

SCHEMBL14927103

Cc1cc2cc(-c3cccc(-c4cccc(C(C)(C)C)c4)c3)nc(CO)c2cc1C

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.40
▸ CTSS P25774 1/20 0.40
▸ CTSK P43235 1/20 0.40
▸ RXRA P19793 3/20 0.37
▸ RXRB P28702 3/20 0.37
▸ TMEM97 Q5BJF2 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ CTSA P10619 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ OPRD1 P41143 2/20 0.33
▸ TRPV3 Q8NET8 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ PTGDR Q13258 1/20 0.33
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32

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
SCHEMBL14927111 0.97 CTSK (0.42) KIF11CTSSCTSKRXRARXRB
SCHEMBL14927099 0.92 DHODH (0.39) KIF11CTSSCTSKRXRARXRB
SCHEMBL14927107 0.86 MAPT (0.37) CTSAKDM4EMAPTALDH1A1
SCHEMBL9986250 0.86 KDM4E (0.51) KIF11CTSSCTSKKDM4EMAPT
SCHEMBL14927119 0.85 CTSS (0.42) KIF11CTSSCTSKRXRARXRB
SCHEMBL14927101 0.84 KIF11 (0.46) KIF11CTSSCTSKRXRARXRB
SCHEMBL14927018 0.84 KIF11 (0.39) KIF11CTSSCTSKRXRARXRB
SCHEMBL9985323 0.83 KDM4E (0.53) KIF11CTSSCTSKKDM4EMAPT
SCHEMBL14927109 0.82 KIF11 (0.45) KIF11CTSSCTSKRXRARXRB
SCHEMBL14927019 0.81 CTSS (0.38) KIF11CTSSCTSKRXRARXRB

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-8933096-B2 Antimicrobial agents Rugers, The State University of New Jersey (US) 2015-01-13 — — US disclosed
US-20130116278-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2013-05-09 — — 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-20130116278-A1 ANTIMICROBIAL AGENTS MRPL21, ARG1, RPP30 KIF11 4094/4885CTSS 1995/4885CTSK 2530/4885

“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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