SCHEMBL412846

SCHEMBL412846

Nc1ccc(-c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.74
KMT2A Q03164 10/20 0.74
MAPT P10636 10/20 0.74
ALDH1A1 P00352 10/20 0.74
SMN1; SMN2 Q16637 9/20 0.74
KDM4E B2RXH2 8/20 0.74
HPGD P15428 8/20 0.74
POLB P06746 8/20 0.74
GLA P06280 5/20 0.74
NFKB1 P19838 3/20 0.74
HSD17B10 Q99714 3/20 0.74
USP2 O75604 3/20 0.74
BLM P54132 3/20 0.74
RECQL P46063 2/20 0.74
THRB P10828 2/20 0.74
PKM P14618 2/20 0.74
TDP1 Q9NUW8 2/20 0.74
GMNN O75496 1/20 0.74
CYP3A4 P08684 1/20 0.74
APEX1 P27695 1/20 0.74

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
SCHEMBL15443953 0.92 MEN1 (0.87) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL419961 0.86 MEN1 (0.77) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL12351750 0.85 MEN1 (1.00) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL363703 0.85 MEN1 (1.00) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7652960 0.85 KDM4E (0.61) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL8174405 0.85 KDM4E (0.61) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL415316 0.84 NPC1 (0.69) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL8130397 0.84 MEN1 (0.65) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL2251258 0.83 MEN1 (1.00) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL14030832 0.83 MMP2 (0.66) KMT2AALDH1A1KDM4EHPGDMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9763925-B2 Antibacterial compounds SUMMIT THERAPEUTICS PLC (GB) 2017-09-19 US disclosed
EP-3095783-A1 ANTIBACTERIAL COMPOUNDS Summit Corporation Plc (GB) 2016-11-23 EP disclosed
US-20160184283-A1 ANTIBACTERIAL COMPOUNDS SUMMIT (OXFORD) LIMITED (GB) 2016-06-30 US disclosed
US-9314456-B2 Antibacterial compounds SUMMIT THERAPEUTICS PLC (GB) 2016-04-19 US disclosed
EP-2907813-A1 Antibacterial Compound Summit Corporation Plc (GB) 2015-08-19 EP disclosed
US-20150150861-A1 ANTIBACTERIAL COMPOUNDS SUMMIT (OXFORD) LIMITED (GB) 2015-06-04 US disclosed
US-8975416-B2 Antibacterial compounds SUMMIT CORPORATION PLC (GB) 2015-03-10 US disclosed
EP-2373631-B1 ANTIBACTERIAL COMPOUNDS SUMMIT CORP PLC (GB) 2015-02-25 EP disclosed
US-20120020950-A1 ANTIBACTERIAL COMPOUNDS SUMMIT CORPORATION PLC 2012-01-26 US disclosed
CN-102227411-A Antibacterial compounds SUMMIT CORP PLC 2011-10-26 CN disclosed
EP-2373631-A2 ANTIBACTERIAL COMPOUNDS Summit Corporation Plc (GB) 2011-10-12 EP disclosed
WO-2010063996-A2 ANTIBACTERIAL COMPOUNDS SUMMIT CORPORATION PLC (GB) 2010-06-10 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-20160184283-A1 ANTIBACTERIAL COMPOUNDS MRPL21, RPN2, ALPI MEN1 3400/4885KMT2A 4829/4885MAPT 2963/4885
US-20120020950-A1 ANTIBACTERIAL COMPOUNDS RPN2, MRPL21, ALPI MEN1 3476/4885KMT2A 4829/4885MAPT 3002/4885
US-20150150861-A1 ANTIBACTERIAL COMPOUNDS MRPL21, RPN2, ALPI MEN1 3400/4885KMT2A 4829/4885MAPT 2963/4885

“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.