SCHEMBL9975372

SCHEMBL9975372

COc1c(C#N)c2cc(Cl)c(Cl)cc2n1[C@H]1CC(O)[C@@H](CO)O1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.33
▸ CSNK2A2 P19784 1/20 0.33
▸ CSNK2B P67870 1/20 0.33
▸ CSNK2A1 P68400 1/20 0.33
▸ CSNK2A3 Q8NEV1 1/20 0.33
▸ LMNA P02545 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ PNP P00491 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ TK1 P04183 2/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ TK2 O00142 1/20 0.31
▸ ADRB1 P08588 1/20 0.31
▸ DNMT1 P26358 1/20 0.31
▸ PRKD3 O94806 1/20 0.31
▸ PRKCG P05129 1/20 0.31

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
SCHEMBL1627311 1.00 PIM1 (0.33) PIM1CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL1624998 0.86 LMNA (0.35) PIM1CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL9975374 0.86 LMNA (0.35) PIM1CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL9975369 0.82 TK1 (0.34) PIM1CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL1626343 0.82 TK1 (0.34) PIM1CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL9975366 0.81 HDAC6 (0.45) ADORA3
SCHEMBL1627706 0.81 HDAC6 (0.45) ADORA3
SCHEMBL9975420 0.76 LMNA (0.37) PIM1CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL9975373 0.72 LMNA (0.35) PIM1CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL1626320 0.72 LMNA (0.35) PIM1CSNK2A2CSNK2BCSNK2A1CSNK2A3

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-20120270827-A1 Indole Antiviral Compositions And Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-10-25 — — US disclosed
US-8202844-B2 Indole antiviral compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-06-19 — — US disclosed
US-20110178038-A1 Indole Antiviral Compositions And Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-07-21 — — US disclosed
US-7928080-B2 Indole antiviral compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-04-19 — — US disclosed
US-7625871-B2 Indole antiviral compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-12-01 — — US disclosed
US-20090281052-A1 Indole Antiviral Compositions And Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-11-12 — — US disclosed
US-7419963-B2 Indole antiviral compositions and methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-09-02 — — US disclosed
US-20080146517-A1 Indole Antiviral Compositions And Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-06-19 — — 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 (4 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-20090281052-A1 Indole Antiviral Compositions And Methods IDO1, IDO2, MAVS PIM1 506/4885CSNK2A2 855/4885CSNK2B 829/4885
US-20120270827-A1 Indole Antiviral Compositions And Methods IDO1, IDO2, MAVS PIM1 506/4885CSNK2A2 855/4885CSNK2B 829/4885
US-20080146517-A1 Indole Antiviral Compositions And Methods IDO1, IDO2, MAVS PIM1 506/4885CSNK2A2 855/4885CSNK2B 829/4885
US-20110178038-A1 Indole Antiviral Compositions And Methods IDO1, IDO2, MAVS PIM1 506/4885CSNK2A2 855/4885CSNK2B 829/4885

“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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