SCHEMBL9900099

SCHEMBL9900099

CCCCNC(=O)c1c[c]c(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
L3MBTL1 Q9Y468 1/20 0.51
MLYCD O95822 1/20 0.50
NAAA Q02083 2/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
HDAC3 O15379 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
CA2 P00918 1/20 0.46
ALDH1A1 P00352 2/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
HPGD P15428 1/20 0.43
NAMPT P43490 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL9900386 0.91 ALDH1A1 (0.49) SMN1; SMN2L3MBTL1MLYCDNAAAHTT
SCHEMBL9900587 0.84 CA12 (0.41) HDAC1ALDH1A1HPGDMEN1MAPT
SCHEMBL28326194 0.80 L3MBTL1 (0.73) SMN1; SMN2L3MBTL1MLYCDNAAATSHR
SCHEMBL12615099 0.75 HDAC8 (0.48) SMN1; SMN2TSHRHTTHDAC2CA2
SCHEMBL12989186 0.75 SMN1; SMN2 (0.66) SMN1; SMN2L3MBTL1MLYCDNAAATSHR
SCHEMBL24386079 0.74 L3MBTL1 (0.71) SMN1; SMN2L3MBTL1MLYCDNAAAHDAC3
SCHEMBL13494653 0.74 L3MBTL1 (0.61) SMN1; SMN2L3MBTL1MLYCDNAAATSHR
SCHEMBL4318844 0.74 SMN1; SMN2 (0.64) SMN1; SMN2L3MBTL1MLYCDNAAATSHR
SCHEMBL178367 0.74 L3MBTL1 (0.87) SMN1; SMN2L3MBTL1MLYCDNAAATSHR
SCHEMBL22919705 0.74 L3MBTL1 (0.65) SMN1; SMN2L3MBTL1MLYCDNAAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9187486-B2 Bicyclic pyridazine compounds as Pim inhibitors AMGEN INC. (US) 2015-11-17 US claimed
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 US claimed
US-20140221344-A1 Bicyclic Pyridazine Compounds as PIM Inhibitors AMGEN INC. 2014-08-07 US claimed
EP-2702063-A1 BICYCLIC PYRIDAZINE COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2014-03-05 EP claimed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 US claimed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 EP claimed
WO-2012148775-A1 BICYCLIC PYRIDAZINE COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-11-01 WO claimed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 WO claimed
US-9187486-B2 Bicyclic pyridazine compounds as Pim inhibitors AMGEN INC. (US) 2015-11-17 US disclosed
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 US disclosed
EP-2796456-A1 Bicyclic compounds as Pim inhibitors Amgen Inc. (US) 2014-10-29 EP disclosed
US-20140221344-A1 Bicyclic Pyridazine Compounds as PIM Inhibitors AMGEN INC. 2014-08-07 US disclosed
EP-2702063-A1 BICYCLIC PYRIDAZINE COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2014-03-05 EP disclosed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 US disclosed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 EP disclosed
WO-2012148775-A1 BICYCLIC PYRIDAZINE COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-11-01 WO disclosed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 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 (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-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS PIM1, PIM2, PIM3 SMN1; SMN2 4085/4885L3MBTL1 1581/4885MLYCD 800/4885
US-20140221344-A1 Bicyclic Pyridazine Compounds as PIM Inhibitors PIM1, PIM2, PIM3 SMN1; SMN2 3773/4885L3MBTL1 2307/4885MLYCD 1291/4885

“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.