SCHEMBL176199

SCHEMBL176199

COc1cn(-c2ccc(F)cc2)nc1C(=O)Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
MEN1 O00255 4/20 0.50
LMNA P02545 1/20 0.50
KDM4E B2RXH2 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
POLB P06746 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CTSA P10619 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40

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
SCHEMBL167729 0.87 KMT2A (0.55) KMT2ANPC1RAB9AMEN1LMNA
SCHEMBL168201 0.86 KMT2A (0.50) KMT2ANPC1RAB9AMEN1LMNA
SCHEMBL176089 0.85 NPC1 (0.56) KMT2ANPC1RAB9AMEN1LMNA
SCHEMBL167504 0.85 NPC1 (0.47) KMT2ANPC1RAB9AMEN1LMNA
SCHEMBL167000 0.81 NPC1 (0.73) KMT2ANPC1RAB9AMEN1LMNA
SCHEMBL23749363 0.80 AURKA (0.45) KMT2ANPC1RAB9AMEN1POLB
SCHEMBL30031094 0.80 AURKA (0.45) KMT2ANPC1RAB9AMEN1POLB
SCHEMBL168920 0.80 NPC1 (0.46) KMT2ANPC1RAB9ALMNAKDM4E
SCHEMBL167649 0.79 NPC1 (0.45) KMT2ANPC1RAB9ALMNAKDM4E
SCHEMBL167619 0.78 NPC1 (0.44) KMT2ANPC1RAB9ALMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103124729-B As the pharmaceutical active compounds of Axl inhibitor LEAD DISCOVERY CENTER GMBH (DE) 2016-01-20 CN disclosed
US-8999982-B2 Pharmaceutically active compounds as Axl inhibitors LEAD DISCOVERY CENTER GMBH (DE) 2015-04-07 US disclosed
EP-2609091-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2014-11-26 EP disclosed
US-20140018365-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FÖRDERUNG DER WISSENSCCHAFTEN E.V. (DE) 2014-01-16 US disclosed
EP-2609091-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS Lead Discovery Center GmbH (DE) 2013-07-03 EP disclosed
WO-2012028332-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2012-03-08 WO disclosed
EP-2423208-A1 Pharmaceutically active compounds as Axl inhibitors Lead Discovery Center GmbH (DE) 2012-02-29 EP 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-20140018365-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS AXL, FLT3, ERBB3 KMT2A 1175/4885NPC1 3417/4885RAB9A 1235/4885

“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.