SCHEMBL6707936

SCHEMBL6707936

Cn1c(C(=O)Nc2ccc(C#N)cc2-c2nnn[nH]2)cc2c(Br)cc(Br)c(NC(=O)Cc3ccccc3)c21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
PARP14 Q460N5 1/20 0.34
EGLN2 Q96KS0 1/20 0.32
IDO1 P14902 1/20 0.32
RORC P51449 3/20 0.31
GALR3 O60755 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA5A P35218 1/20 0.30
CA7 P43166 1/20 0.30
CA5B Q9Y2D0 1/20 0.30
ALDH1A1 P00352 2/20 0.30
GAA P10253 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL6709946 0.91 LMNA (0.36) LMNAPARP14EGLN2IDO1RORC
SCHEMBL6710049 0.90 HIF1A (0.39) LMNAGALR3HTTRAB9ASMN1; SMN2
SCHEMBL6712257 0.89 ALDH1A1 (0.36) LMNARORCGALR3HTTRAB9A
SCHEMBL6710244 0.86 PARP14 (0.34) LMNAPARP14EGLN2IDO1RORC
SCHEMBL6710232 0.84 NTRK1 (0.34) LMNAPARP14RORC
SCHEMBL6833968 0.83 LMNA (0.40) LMNAEGLN2RORCGALR3HTT
SCHEMBL6707739 0.83
SCHEMBL6713282 0.81 HIF1A (0.40) LMNAGALR3HTTRAB9ASMN1; SMN2
SCHEMBL6711870 0.80 FBP1 (0.31)
SCHEMBL6710388 0.80 L3MBTL1 (0.38) LMNARORCSMN1; SMN2CA1CA2

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 LMNA 4062/4885PARP14 2597/4885EGLN2 54/4885

“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.