SCHEMBL8424664

SCHEMBL8424664

CCNC(=O)Cc1ccc(Cl)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 5/20 0.61
ERCC4 Q92889 5/20 0.61
KMT2A Q03164 1/20 0.56
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
P2RX7 Q99572 6/20 0.54
HPGD P15428 2/20 0.54
LMNA P02545 1/20 0.54
MAPK1 P28482 1/20 0.54
NLRP1 Q9C000 1/20 0.54
TSHR P16473 1/20 0.54
GALR3 O60755 1/20 0.52
NR2F2 P24468 1/20 0.52

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
SCHEMBL25252399 0.84 TSHR (0.47) ERCC1ERCC4KMT2ANPC1RAB9A
SCHEMBL4247795 0.83 ERCC1 (0.56) ERCC1ERCC4KMT2ANPC1RAB9A
SCHEMBL9393209 0.83 KDM4E (0.49) ERCC1ERCC4KMT2AP2RX7HPGD
SCHEMBL8744740 0.82 ERCC1 (0.59) ERCC1ERCC4KMT2ANPC1RAB9A
SCHEMBL8744815 0.81 GAA (0.56) ERCC1ERCC4KMT2ANPC1RAB9A
SCHEMBL6136388 0.80 ERCC1 (0.48) ERCC1ERCC4KMT2AP2RX7HPGD
SCHEMBL17914676 0.80 ALDH1A1 (0.62) ERCC1ERCC4NPC1RAB9AP2RX7
SCHEMBL8204517 0.80 ERCC1 (0.54) ERCC1ERCC4KMT2ANPC1RAB9A
SCHEMBL9523440 0.79 ALDH1A1 (0.65) ERCC1ERCC4KMT2ANPC1RAB9A
SCHEMBL30545006 0.79 ALDH1A1 (0.65) ERCC1ERCC4KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090011977-A1 Novel Lipopeptides as Antibacterial Agents HILL JASON 2009-01-08 US disclosed
US-20080287347-A1 Novel Lipopeptides as Antibacterial Agents CUBIST PHARMACEUTICALS, INC. 2008-11-20 US disclosed
US-7408025-B2 Lipopeptides as antibacterial agents CUBIST PHARMACEUTICALS, INC. (US) 2008-08-05 US disclosed
US-7335725-B2 Lipopeptides as antibacterial agents CUBIST PHARMACEUTICALS, INC. (US) 2008-02-26 US disclosed
US-20050203006-A1 Novel lipopeptides as antibacterial agents MERCK SHARP & DOHME CORP. 2005-09-15 US 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-20050203006-A1 Novel lipopeptides as antibacterial agents CLPTM1, NGLY1, VIP ERCC1 3679/4885ERCC4 1687/4885KMT2A 4561/4885
US-20080287347-A1 Novel Lipopeptides as Antibacterial Agents CLPTM1, NGLY1, VIP ERCC1 3679/4885ERCC4 1687/4885KMT2A 4561/4885
US-20090011977-A1 Novel Lipopeptides as Antibacterial Agents CLPTM1, NGLY1, VIP ERCC1 3679/4885ERCC4 1687/4885KMT2A 4561/4885

“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.