SCHEMBL14373604

SCHEMBL14373604

COCCCn1c(=N)n(CC(=O)c2ccc(Br)cc2)c2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CXCR3 P49682 8/20 0.68
▸ KMT2A Q03164 4/20 0.61
▸ ATM Q13315 1/20 0.61
▸ RAB9A P51151 4/20 0.60
▸ MAPT P10636 3/20 0.59
▸ MEN1 O00255 2/20 0.55
▸ BRSK1 Q8TDC3 1/20 0.55
▸ AURKB Q96GD4 1/20 0.55
▸ ALDH1A1 P00352 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ NPC1 O15118 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.51
▸ GAA P10253 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
SCHEMBL14470558 0.88 CXCR3 (0.56) CXCR3KMT2AATMRAB9AMAPT
SCHEMBL5461816 0.87 CXCR3 (0.73) CXCR3KMT2AATMRAB9AMAPT
SCHEMBL14373634 0.86 CXCR3 (0.59) CXCR3KMT2AATMBRSK1AURKB
SCHEMBL14373603 0.86 BRSK1 (0.74) CXCR3KMT2AATMRAB9AMAPT
SCHEMBL14373251 0.85 CXCR3 (0.81) CXCR3KMT2AATMRAB9AMAPT
SCHEMBL5449881 0.84 CXCR3 (0.77) CXCR3KMT2AATMRAB9AMAPT
SCHEMBL5461913 0.81 CXCR3 (0.76) CXCR3KMT2AATMRAB9AMAPT
SCHEMBL14758273 0.81 CXCR3 (1.00) CXCR3KMT2AATMRAB9AMAPT
SCHEMBL14373248 0.81 CXCR3 (0.70) CXCR3KMT2AATMRAB9AMAPT
SCHEMBL14373259 0.81 CXCR3 (0.70) CXCR3KMT2AATMRAB9AMAPT

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-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

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 4743/4885KMT2A 1857/4885ATM 2090/4885

“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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