SCHEMBL5858877

SCHEMBL5858877

CS(=O)(=O)n1c(CI)nc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 3/20 0.43
ALDH3A1 P30838 3/20 0.43
PKM P14618 2/20 0.43
APEX1 P27695 1/20 0.43
GAA P10253 3/20 0.43
TSHR P16473 2/20 0.43
TP53 P04637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PIK3CB P42338 1/20 0.42
CYP2C19 P33261 1/20 0.42
CXCL8 P10145 2/20 0.42
NOD1 Q9Y239 2/20 0.42
NOD2 Q9HC29 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL5859680 0.84 MEN1 (0.50) CYP1A2CYP3A4CYP2D6SMN1; SMN2USP2
SCHEMBL7748824 0.79 CYP1A2 (0.45) CYP1A2CYP3A4CYP2D6SMN1; SMN2USP2
SCHEMBL9039161 0.78 CYP1A2 (0.55) CYP1A2CYP3A4CYP2D6SMN1; SMN2USP2
SCHEMBL8034260 0.75 SMN1; SMN2 (0.49) CYP1A2CYP3A4CYP2D6SMN1; SMN2USP2
SCHEMBL7837246 0.75 SMN1; SMN2 (0.56) CYP1A2SMN1; SMN2LMNAALDH3A1GAA
SCHEMBL4873241 0.75 NOD1 (0.66) CYP1A2CYP2D6SMN1; SMN2ALDH3A1GAA
SCHEMBL2792751 0.74 LMNA (0.61) CYP2D6SMN1; SMN2USP2LMNAPKM
SCHEMBL16376073 0.70 TDP1 (0.58) SMN1; SMN2LMNAGAATSHRTP53
SCHEMBL2794427 0.69 APEX1 (0.51) CYP1A2CYP3A4CYP2D6SMN1; SMN2LMNA
SCHEMBL7100805 0.67 ALDH3A1 (0.61) USP2LMNAALDH3A1GAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030140-B2 Substituted benzimidazole antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2006-04-18 US disclosed
US-6908936-B2 Substituted benzimidazole antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2005-06-21 US disclosed
US-20050038085-A1 Substituted benzimidazole antiviral agents YU KUO-LONG (US) 2005-02-17 US disclosed
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed
US-20030139450-A1 Substituted benzimidazole antiviral agents YU KUO-LONG (US) 2003-07-24 US disclosed
US-6506738-B1 Treatment of viral infections. More particularly, the invention provides benzimidazolone derivatives for the treatment of respiratory syncytial virus infection. BRISTOL-MYERS SQUIBB COMPANY 2003-01-14 US disclosed
WO-2002026228-A1 BENZIMIDAZOLONE ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-04-04 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 (2 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-20050038085-A1 Substituted benzimidazole antiviral agents MAVS, ZC3HAV1, ZC3HAV1L CYP1A2 1840/4885CYP3A4 174/4885CYP2D6 897/4885
US-20030139450-A1 Substituted benzimidazole antiviral agents MAVS, ZC3HAV1, ZC3HAV1L CYP1A2 1840/4885CYP3A4 174/4885CYP2D6 897/4885

“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.