SCHEMBL5881069

SCHEMBL5881069

Cc1ccc(S(=O)(=O)Sc2cc3nc(N)sc3cc2C(C)(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HSD17B10 Q99714 2/20 0.48
HTT P42858 2/20 0.48
USP2 O75604 1/20 0.48
HPGD P15428 3/20 0.44
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 2/20 0.44
PKM P14618 1/20 0.44
RAB9A P51151 1/20 0.44
CYP3A4 P08684 3/20 0.40
TSHR P16473 2/20 0.40
TP53 P04637 1/20 0.40
GAA P10253 3/20 0.38
DNMT1 P26358 1/20 0.38
VDR P11473 1/20 0.37
GFER P55789 1/20 0.37
GPR55 Q9Y2T6 1/20 0.37

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
SCHEMBL6302939 0.95 ALDH1A1 (0.48) ALDH1A1MAPTLMNASMN1; SMN2HSD17B10
SCHEMBL6296223 0.80 ALDH1A1 (0.48) ALDH1A1MAPTLMNASMN1; SMN2HSD17B10
SCHEMBL6296402 0.78 DNMT1 (0.47) ALDH1A1MAPTHTTKDM4EKMT2A
SCHEMBL6296484 0.77 ALDH1A1 (0.41) ALDH1A1MAPTLMNASMN1; SMN2HSD17B10
SCHEMBL6303226 0.77 DYRK1A (0.52) ALDH1A1MAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL5880835 0.75 DNMT1 (0.45) ALDH1A1LMNAKDM4EKMT2AGAA
Hydrochloric Acid SCHEMBL5880769 0.74 DNMT1 (0.44) ALDH1A1LMNAKDM4EKMT2AGAA
SCHEMBL8702569 0.71 DNMT1 (0.46) ALDH1A1KMT2AGAADNMT1CA2
SCHEMBL8008611 0.70 DNMT1 (0.45) ALDH1A1MAPTLMNASMN1; SMN2HTT
SCHEMBL6381936 0.70 TDP1 (0.40) SMN1; SMN2KMT2ARAB9ACYP3A4GAA

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-7115658-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase AGOURON PHARMACEUTICALS, INC. (US) 2006-10-03 US disclosed
US-20040023958-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. 2004-02-05 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-20040023958-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same POLRMT, RNGTT, RNASE1 ALDH1A1 729/4885MAPT 2903/4885LMNA 3489/4885

“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.