SCHEMBL5035998

SCHEMBL5035998

COC(=O)Nc1nc2cc(O)ccc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 9/20 0.54
CYP1A2 P05177 6/20 0.54
HIF1A Q16665 5/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
KDR P35968 3/20 0.54
ALDH1A1 P00352 3/20 0.54
ABL1 P00519 2/20 0.54
CYP2C9 P11712 2/20 0.54
HTT P42858 2/20 0.54
CYP2C19 P33261 1/20 0.54
ABCC4 O15439 1/20 0.54
USP2 O75604 1/20 0.54
TUBB4A P04350 6/20 0.53
TUBB P07437 6/20 0.53
TUBA3C P0DPH7 6/20 0.53
TUBA1B P68363 6/20 0.53
TUBA4A P68366 6/20 0.53
TUBB4B P68371 6/20 0.53
TUBB3 Q13509 6/20 0.53
TUBB2A Q13885 6/20 0.53

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
SCHEMBL5037530 0.88 LMNA (0.64) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL5037713 0.86 LCK (0.56) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL11402160 0.85 TUBB4A (0.60) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL5345714 0.85 LMNA (0.65) LMNASMN1; SMN2ALDH1A1TUBB4ATUBB
SCHEMBL5351438 0.84 LMNA (0.53) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL31265132 0.84 TUBB4A (0.61) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL11087273 0.84 LMNA (0.53) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL11171719 0.84 NPC1 (0.55) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL11873285 0.84 KDR (0.56) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL4637243 0.83 NPC1 (0.48) LMNASMN1; SMN2ALDH1A1TUBB4ATUBB

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-1432417-B1 SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCER AVENTIS PHARMA SA (FR) 2008-02-20 EP disclosed
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
EP-1432417-A2 SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCER Aventis Pharma S.A. (FR) 2004-06-30 EP disclosed
WO-2003028721-A2 SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCER AVENTIS PHARMA S.A. (FR) 2003-04-10 WO disclosed
US-4639463-A Substituted phenylsulfonyloxybenzimidazolecarbamates and anthelmintic compositions HOECHST AKTIENGESELLSCHAFT (DE) 1987-01-27 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 LMNA 4225/4885CYP1A2 734/4885HIF1A 2555/4885

“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.