SCHEMBL21245271

SCHEMBL21245271

CCOC(=O)Cc1cn(CCCCCCN)c2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ICMT O60725 4/20 0.62
CDC25A P30304 1/20 0.60
CREBBP Q92793 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CNR1 P21554 3/20 0.50
CNR2 P34972 2/20 0.48
MCL1 Q07820 2/20 0.47
LMNA P02545 1/20 0.47
ALOX5 P09917 1/20 0.46
TERT O14746 1/20 0.46

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
SCHEMBL21246049 0.88 ICMT (0.61) ICMTCDC25ACNR1CNR2MCL1
SCHEMBL8416334 0.88 CDC25A (0.65) ICMTCDC25ACREBBPL3MBTL1CNR1
SCHEMBL28840780 0.87 CREBBP (0.62) ICMTCDC25ACREBBPL3MBTL1CNR1
SCHEMBL9038902 0.86 CDC25A (0.56) ICMTCDC25ACREBBPL3MBTL1CNR1
SCHEMBL21245248 0.84 CDC25A (0.56) ICMTCDC25ACREBBPL3MBTL1CNR1
SCHEMBL16259057 0.82 ICMT (0.61) ICMTCDC25ACNR2
SCHEMBL14333614 0.82 CNR1 (0.68) CREBBPCNR1CNR2LMNA
SCHEMBL18171795 0.81 ALDH1A1 (0.66) CREBBPL3MBTL1LMNAALOX5
SCHEMBL17102877 0.80 CDC25A (0.75) ICMTCDC25ACNR1CNR2
SCHEMBL15747719 0.80 CDC25A (0.75) ICMTCDC25ACNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230124268-A1 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME UNIV INDIANA TRUSTEES (US) 2023-04-20 US disclosed
US-11584766-B2 Nicotinamide phosphoribosyltransferase inhibitors and methods for use of the same THE TRUSTEES OF INDIANA UNIVERSITY (US) 2023-02-21 US disclosed
US-20210070784-A1 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2021-03-11 US disclosed
WO-2019153007-A2 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME THE BOARO OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2019-08-08 WO 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 (3 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-20210070784-A1 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME NAMPT, NNT, NAPRT ICMT 387/4885CDC25A 3597/4885CREBBP 833/4885
US-20230124268-A1 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME NAMPT, NNT, NAPRT ICMT 387/4885CDC25A 3597/4885CREBBP 833/4885
US-11584766-B2 Nicotinamide phosphoribosyltransferase inhibitors and methods for use of the same NAMPT, NNT, NAPRT ICMT 387/4885CDC25A 3597/4885CREBBP 833/4885

“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.