SCHEMBL3698764

SCHEMBL3698764

O=C1[N]N=C(F)c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CDC25B P30305 2/20 0.36
TDP2 O95551 3/20 0.35
MAOA P21397 2/20 0.35
PLCG1 P19174 2/20 0.35
CES1 P23141 2/20 0.35
POLB P06746 2/20 0.35
APAF1 O14727 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CES2 O00748 1/20 0.35
TERT O14746 1/20 0.35
NPC1 O15118 1/20 0.35
PLIN1 O60240 1/20 0.35
S1PR4 O95977 1/20 0.35
LMNA P02545 1/20 0.35
PLA2G1B P04054 1/20 0.35
BCHE P06276 1/20 0.35
PTPRC P08575 1/20 0.35
MAPT P10636 1/20 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
SCHEMBL3697487 0.76 MEN1 (0.39) MEN1KMT2ACDC25BTDP2MAOA
SCHEMBL25297698 0.73 IDO1 (0.33) NPC1IDO1
SCHEMBL2072302 0.73 CDC25B (0.39) MEN1KMT2ACDC25BTDP2MAOA
SCHEMBL3705255 0.72 HSD11B1 (0.34) MEN1KMT2ACDC25BTDP2MAOA
SCHEMBL29714477 0.66 MEN1 (0.50) MEN1KMT2ACDC25BTDP2MAOA
SCHEMBL112133 0.66 MEN1 (0.50) MEN1KMT2ACDC25BTDP2MAOA
SCHEMBL19888 0.66 MEN1 (0.50) MEN1KMT2ACDC25BTDP2MAOA
SCHEMBL9569910 0.66 PTPN1 (0.40) MAOAMAPK1TDP1MAOB
SCHEMBL30218501 0.64 MEN1 (0.47) MEN1KMT2ACDC25BTDP2MAOA
SCHEMBL879050 0.62 CDC25B (0.39) MEN1KMT2ACDC25BTDP2MAOA

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10093624-B2 NAMPT and ROCK inhibitors ABBVIE INC. (US) 2018-10-09 US disclosed
EP-2776393-B1 NAMPT INHIBITORS ABBVIE INC (US) 2017-12-20 EP disclosed
US-9758511-B2 NAMPT inhibitors ABBVIE INC. (US) 2017-09-12 US disclosed
US-20170253562-A1 Nampt Inhibitors ABBVIE INC (US) 2017-09-07 US disclosed
US-20170135994-A9 NAMPT INHIBITORS ABBVIE INC. (US) 2017-05-18 US disclosed
US-20170065575-A1 NAMPT INHIBITORS ABBVIE INC (US) 2017-03-09 US disclosed
US-20160193209-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2016-07-07 US disclosed
US-20160184282-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2016-06-30 US disclosed
US-20160184281-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2016-06-30 US disclosed
US-20160168134-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2016-06-16 US disclosed
US-20140336168-A1 NAMPT INHIBITORS ABBVIE INC. 2014-11-13 US disclosed
US-20140336167-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2014-11-13 US disclosed
US-20130303511-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US disclosed
US-20130303509-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US disclosed
US-20130303510-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US disclosed
US-20130303508-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US disclosed
EP-2640704-A1 NAMPT INHIBITORS Abbvie Inc. (US) 2013-09-25 EP disclosed
WO-2012067963-A1 NAMPT INHIBITORS ABBOTT LABORATORIES (US) 2012-05-24 WO disclosed
US-20120122842-A1 NAMPT AND ROCK INHIBITORS ABBOTT LABORATORIES (US) 2012-05-17 US disclosed
US-20120122924-A1 NAMPT INHIBITORS ABBOTT LABORATORIES (US) 2012-05-17 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 (16 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-20120122924-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-10093624-B2 NAMPT and ROCK inhibitors NAMPT, NNMT, NADK MEN1 1333/4885KMT2A 1248/4885CDC25B 2595/4885
US-20160168134-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20120122842-A1 NAMPT AND ROCK INHIBITORS NAMPT, NNMT, NME2 MEN1 1139/4885KMT2A 2025/4885CDC25B 2577/4885
US-20130303508-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20160184282-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20130303511-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20170253562-A1 Nampt Inhibitors NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20170065575-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20140336168-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20160184281-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20140336167-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20130303510-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20170135994-A9 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20160193209-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885
US-20130303509-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT MEN1 2691/4885KMT2A 2175/4885CDC25B 3000/4885

“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.