SCHEMBL6017699

SCHEMBL6017699

O=S(=O)(Oc1ccc2nc(NCc3nc(-c4ccccc4)no3)[nH]c2c1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 5/20 0.46
RAB9A P51151 4/20 0.46
TP53 P04637 1/20 0.46
ALDH1A1 P00352 5/20 0.45
TSHR P16473 5/20 0.45
NPC1 O15118 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.44
HDAC6 Q9UBN7 2/20 0.41
POLB P06746 1/20 0.40
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
MET P08581 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
CDK9 P50750 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40
TUBB4B P68371 1/20 0.40

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
SCHEMBL5037569 0.94 MAPT (0.46) MAPTKMT2ASMN1; SMN2RAB9ATP53
SCHEMBL5036443 0.88 MAPT (0.42) MAPTKMT2ASMN1; SMN2RAB9ATP53
SCHEMBL5036359 0.76 RAB9A (0.61) KMT2ASMN1; SMN2RAB9ATP53ALDH1A1
SCHEMBL6017773 0.76 RAB9A (0.70) MAPTKMT2ASMN1; SMN2RAB9ATP53
SCHEMBL6018617 0.73 SMN1; SMN2 (0.57) MAPTSMN1; SMN2RAB9ATP53ALDH1A1
SCHEMBL11191139 0.70 MAOB (0.46) MAPTSMN1; SMN2RAB9ATP53ALDH1A1
SCHEMBL5036227 0.70 RAB9A (0.53) SMN1; SMN2RAB9ATP53HDAC6TUBB4A
SCHEMBL5037797 0.69 RAB9A (0.48) SMN1; SMN2RAB9ATP53HDAC6TUBB4A
SCHEMBL5036108 0.68 RAB9A (0.50) KMT2ASMN1; SMN2RAB9ATP53ALDH1A1
SCHEMBL5036435 0.68 RAB9A (0.60) KMT2ASMN1; SMN2RAB9ATP53ALDH1A1

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-7041668-B2 Substituted benzimidazole compounds and their use for the treatment of cancer AVENTIS PHARMA S.A. (FR) 2006-05-09 US disclosed
US-20050014811-A1 Substituted benzimidazole compounds and their use for the treatment of cancer AVENTIS PHARMA S.A. (FR) 2005-01-20 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-20050014811-A1 Substituted benzimidazole compounds and their use for the treatment of cancer CDKL3, CCNL2, CDKL1 MAPT 4854/4885KMT2A 2114/4885SMN1; SMN2 2426/4885

“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.