SCHEMBL419961

SCHEMBL419961

Nc1ccc(-c2nc3cc(-c4ccc5nc(-c6ccc(N)cc6)[nH]c5c4)ccc3[nH]2)cc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.77
KMT2A Q03164 10/20 0.77
ALDH1A1 P00352 10/20 0.77
MAPT P10636 10/20 0.77
SMN1; SMN2 Q16637 9/20 0.77
KDM4E B2RXH2 8/20 0.77
HPGD P15428 8/20 0.77
POLB P06746 8/20 0.77
GLA P06280 5/20 0.77
HSD17B10 Q99714 3/20 0.77
NFKB1 P19838 3/20 0.77
USP2 O75604 3/20 0.77
BLM P54132 3/20 0.77
RECQL P46063 2/20 0.77
PKM P14618 2/20 0.77
THRB P10828 2/20 0.77
TDP1 Q9NUW8 2/20 0.77
GMNN O75496 1/20 0.77
CYP3A4 P08684 1/20 0.77
APEX1 P27695 1/20 0.77

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
SCHEMBL9862039 0.93 ALDH1A1 (0.69) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL15443953 0.93 MEN1 (0.87) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL15443982 0.89 MEN1 (0.87) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL417825 0.87 ALDH1A1 (0.71) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL12351750 0.87 MEN1 (1.00) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10002475 0.87 ALDH1A1 (0.71) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL159873 0.86 ALDH1A1 (0.74) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL28312335 0.86 ALDH1A1 (0.74) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL363703 0.86 MEN1 (1.00) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL30307784 0.86 ALDH1A1 (0.74) MEN1KMT2AALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8975416-B2 Antibacterial compounds SUMMIT CORPORATION PLC (GB) 2015-03-10 US claimed
EP-2373631-B1 ANTIBACTERIAL COMPOUNDS SUMMIT CORP PLC (GB) 2015-02-25 EP claimed
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
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 4829/4885ALDH1A1 1088/4885
US-20120020950-A1 ANTIBACTERIAL COMPOUNDS RPN2, MRPL21, ALPI MEN1 3476/4885KMT2A 4829/4885ALDH1A1 1135/4885
US-20150150861-A1 ANTIBACTERIAL COMPOUNDS MRPL21, RPN2, ALPI MEN1 3400/4885KMT2A 4829/4885ALDH1A1 1088/4885

“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.