SCHEMBL2185939

SCHEMBL2185939

Nc1ccc(-c2ccccc2F)nc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 1/20 0.50
PARP1 P09874 1/20 0.42
NPC1 O15118 1/20 0.42
PIM1 P11309 3/20 0.41
PIM3 Q86V86 3/20 0.41
PIM2 Q9P1W9 3/20 0.41
MAP4K1 Q92918 2/20 0.40
IDO1 P14902 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ADORA2A P29274 1/20 0.39
PDE8A O60658 1/20 0.39
DHPS P49366 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38

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
SCHEMBL1582795 0.81 MPL (0.53) MPLPARP1NPC1PIM1PIM3
SCHEMBL2184737 0.80 PIM1 (0.36) MPLNPC1PIM1PIM3PIM2
SCHEMBL25394131 0.75 L3MBTL1 (0.48) MPLPARP1NPC1MAP4K1KDM4E
SCHEMBL11907598 0.73 PIM2 (0.54) MPLPARP1NPC1PIM1PIM3
SCHEMBL27810693 0.73 MAP2K3 (0.53) NPC1KDM4EALDH1A1ADORA2AL3MBTL1
SCHEMBL2185535 0.72 DHPS (0.46) MPLNPC1KDM4EALDH1A1ADORA2A
SCHEMBL12856726 0.72 NPC1 (0.53) MPLPARP1NPC1MAP4K1IDO1
SCHEMBL29470231 0.72 NPC1 (0.53) MPLPARP1NPC1MAP4K1IDO1
SCHEMBL3935260 0.72 MPL (0.55) MPLPARP1NPC1MAP4K1IDO1
SCHEMBL30166486 0.72 MPL (0.55) MPLPARP1NPC1MAP4K1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735424-B2 Bicyclic kinase inhibitors NOVARTIS AG (CH) 2014-05-27 US disclosed
US-8735424-B2 Bicyclic kinase inhibitors NOVARTIS AG (CH) 2014-05-27 US disclosed
US-8735424-B2 Bicyclic kinase inhibitors NOVARTIS AG (CH) 2014-05-27 US disclosed
CN-102203075-A Bicyclic kinase inhibitors NOVARTIS AG 2011-09-28 CN disclosed
US-20110195980-A1 Bicyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 US disclosed
US-20110195980-A1 Bicyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 US disclosed
US-20110195980-A1 Bicyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 US disclosed
EP-2342190-A1 BICYCLIC KINASE INHIBITORS Novartis AG (CH) 2011-07-13 EP disclosed
WO-2010026121-A1 BICYCLIC KINASE INHIBITORS NOVARTIS AG (CH) 2010-03-11 WO disclosed
WO-2010026121-A1 BICYCLIC KINASE INHIBITORS NOVARTIS AG (CH) 2010-03-11 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 (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-20110195980-A1 Bicyclic Kinase Inhibitors PIM1, PIM2, PIM3 MPL 683/4885PARP1 902/4885NPC1 4431/4885

“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.