SCHEMBL14373523

SCHEMBL14373523

Cn1c(=N)n(CC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc21

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CXCR3 P49682 8/20 0.73
▸ RAB9A P51151 7/20 0.72
▸ NPC1 O15118 6/20 0.72
▸ KMT2A Q03164 6/20 0.72
▸ ATM Q13315 3/20 0.72
▸ MEN1 O00255 3/20 0.72
▸ MAPT P10636 4/20 0.54
▸ POLB P06746 2/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ TP53 P04637 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ GAA P10253 1/20 0.53
▸ F2R P25116 1/20 0.53
▸ MITF O75030 2/20 0.53
▸ HTT P42858 1/20 0.51

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
SCHEMBL14373497 0.85 CXCR3 (1.00) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL14373500 0.83 CXCR3 (0.82) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL14470582 0.80 CXCR3 (0.77) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL14373544 0.80 CXCR3 (0.80) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL14373502 0.79 CXCR3 (0.65) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL5463756 0.79 CXCR3 (1.00) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL14373506 0.78 CXCR3 (1.00) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL14373512 0.76 RAB9A (0.73) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL14373565 0.74 RAB9A (0.78) CXCR3RAB9ANPC1KMT2AATM
SCHEMBL14758273 0.74 CXCR3 (1.00) CXCR3RAB9ANPC1KMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 — — 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 (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 4743/4885RAB9A 1111/4885NPC1 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.

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