SCHEMBL5148368

SCHEMBL5148368

CN(C(=O)Cn1c(=N)n(CC(=O)N(C)c2ccccc2)c2ccccc21)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CXCR3 P49682 3/20 0.54
HTT P42858 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 2/20 0.50
KMT2A Q03164 2/20 0.50
POLQ O75417 1/20 0.49
TSHR P16473 1/20 0.49
HRH1 P35367 1/20 0.49
LMNA P02545 1/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL14373370 0.93 NPC1 (0.63) CXCR3NPC1RAB9AKDM4EKMT2A
SCHEMBL14373371 0.87 CXCR3 (0.66) CXCR3NPC1RAB9AKDM4EKMT2A
SCHEMBL14373372 0.87 CXCR3 (0.74) CXCR3KMT2AMEN1MAPT
SCHEMBL14373373 0.84 CXCR3 (0.58) CXCR3NPC1RAB9AKMT2AMEN1
SCHEMBL14373252 0.76 CXCR3 (0.70) CXCR3NPC1RAB9AKMT2AMEN1
SCHEMBL5418563 0.76 TSPO (0.65)
SCHEMBL14373374 0.76 CXCR3 (0.85) CXCR3HTTNPC1RAB9AALDH1A1
SCHEMBL5452572 0.75 F2R (0.53) HTTLMNAMAPT
SCHEMBL9887 0.74 KMT2A (0.56) NPC1RAB9AALDH1A1KDM4EKMT2A
SCHEMBL4100208 0.72 KDM4E (0.70) CXCR3HTTNPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1983992-A2 2-IMINO-BENZIMIDAZOLES Abbott Laboratories (US) 2008-10-29 EP disclosed
US-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 US disclosed
US-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 US disclosed
US-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 US disclosed
WO-2007084728-A2 2-IMINO-BENZIMIDAZOLES ABBOTT LABORATORIES (US) 2007-07-26 WO disclosed
WO-2007084728-A2 2-IMINO-BENZIMIDAZOLES ABBOTT LABORATORIES (US) 2007-07-26 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-20070232673-A1 2-Imino-benzimidazoles CYP2C19, UGT2B7, UGT2B17 CXCR3 4743/4885HTT 4363/4885NPC1 234/4885

“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.