SCHEMBL4262484

SCHEMBL4262484

O=C(O)Cc1c(C(=O)c2ccccc2-c2ccccc2)sc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRNP P04156 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ ACACA Q13085 1/20 0.41
▸ MCL1 Q07820 3/20 0.40
▸ CHRNB2 P17787 3/20 0.40
▸ CHRNA4 P43681 3/20 0.40
▸ CHRNB4 P30926 2/20 0.40
▸ CHRNA3 P32297 2/20 0.40
▸ BCAT2 O15382 1/20 0.40
▸ CNR1 P21554 2/20 0.38
▸ CNR2 P34972 2/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL4256027 0.87 ACACA (0.46) PRNPRXFP1ACACACHRNB2CHRNA4
SCHEMBL8171489 0.81 MAOB (0.48) MCL1CNR1CNR2SMN1; SMN2KMT2A
SCHEMBL14645285 0.75 CYP1A2 (0.46) MCL1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL14646229 0.74 L3MBTL1 (0.43) MCL1CNR1CNR2SMN1; SMN2MEN1
SCHEMBL4180054 0.72 MCL1 (0.43) PRNPRXFP1MCL1SMN1; SMN2MEN1
SCHEMBL27539732 0.72 IKBKB (0.45) MCL1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL4256044 0.71 KDM4E (0.52) KDM4EMAPTALDH1A1
SCHEMBL4254952 0.71 MAPT (0.40) ACACAMCL1CHRNB2CHRNA4CHRNB4
SCHEMBL14646177 0.70 CYP1A2 (0.42) ACACAMCL1SMN1; SMN2MEN1KMT2A
SCHEMBL5763556 0.69 MCL1 (0.49) MCL1SMN1; SMN2MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2134683-A2 NOVEL INHIBITORS HEPATITIS C VIRUS REPLICATION Intermune, Inc. (US) 2009-12-23 — — EP disclosed
US-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2009-02-19 — — US disclosed
WO-2008100867-A2 NOVEL INHIBITORS HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2008-08-21 — — 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 (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-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, HCCS PRNP 1827/4885RXFP1 3246/4885ACACA 227/4885

“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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