SCHEMBL6708920

SCHEMBL6708920

N#Cc1ccc(NC(=O)c2cc3cccc(NC(=O)Cc4ccc5ccccc5c4)c3[nH]2)c(-c2nnn[nH]2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 3/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
AKT1 P31749 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
NR1H4 Q96RI1 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MAPK8 P45983 1/20 0.35
MAPK10 P53779 1/20 0.35
NLRP3 Q96P20 1/20 0.35
CCNB2 O95067 1/20 0.35
CCNE2 O96020 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
CCNA2 P20248 1/20 0.35

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
SCHEMBL6711927 0.93 PARP14 (0.44) PARP14LMNATP53POLBMAPT
SCHEMBL6713731 0.92 PARP14 (0.41) PARP14MEN1KMT2AAKT1EGLN1
SCHEMBL6711435 0.91 PARP14 (0.42) PARP14MEN1KMT2ALMNAPOLB
SCHEMBL6713375 0.91 PARP14 (0.39) PARP14HDAC3HDAC1HDAC2CCNA2
SCHEMBL6709947 0.91 PARP14 (0.39) PARP14HDAC1HDAC2NPC1RAB9A
SCHEMBL6712091 0.91 PARP14 (0.39) PARP14MEN1KMT2AHDAC1L3MBTL1
SCHEMBL6916001 0.91 PARP14 (0.42) PARP14MEN1KMT2AHDAC3HDAC1
SCHEMBL6765701 0.90 CACNA1H (0.38) PARP14NLRP3TP53MAPT
SCHEMBL6707721 0.90 PARP14 (0.41) PARP14MEN1KMT2AHDAC1MAPK8
SCHEMBL6713522 0.90 PARP14 (0.41) PARP14HDAC1LMNATP53POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 US disclosed
WO-2004018461-A2 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 PARP14 2597/4885MEN1 4100/4885KMT2A 3181/4885

“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.