SCHEMBL1936635

SCHEMBL1936635

CNC(=O)c1c(-c2ccc(F)cc2)nn2ccc(-c3cc(C(=O)N(C4CC4)C4CC4)c(OC)cc3C)c(F)c12

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 1/20 0.33
CSNK1D P48730 1/20 0.33
CSNK1E P49674 1/20 0.33
BTK Q06187 2/20 0.32
MAP3K5 Q99683 2/20 0.31
PIK3CD O00329 1/20 0.31
ROCK2 O75116 1/20 0.31
ROCK1 Q13464 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
TTK P33981 1/20 0.31
POLB P06746 1/20 0.31
EGFR P00533 1/20 0.31
PDE4B Q07343 1/20 0.31
ABL1 P00519 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
SCHEMBL1936236 0.97 CNR2 (0.34) TYK2CSNK1DCSNK1EBTKCNR1
SCHEMBL2432013 0.88 CSF1R (0.31) TYK2CNR2
SCHEMBL1934770 0.87 CSNK1D (0.37) CSNK1DCSNK1EBTKMAP3K5ROCK2
SCHEMBL1936633 0.85 CSNK1D (0.33) CSNK1DCSNK1EBTKMAP3K5EGFR
SCHEMBL2431185 0.84 RET (0.37) CSNK1DCSNK1EBTK
SCHEMBL2465747 0.83 CNR2 (0.34) CSNK1DCSNK1EBTKCNR1CNR2
SCHEMBL2464594 0.83 CYP2C8 (0.38) CSNK1DCSNK1EBTKEGFR
SCHEMBL2467318 0.83 BTK (0.34) CSNK1DCSNK1EBTKMAP3K5ROCK2
SCHEMBL2997319 0.81 CYP2C8 (0.42) CSNK1DCSNK1EBTKROCK2ROCK1
SCHEMBL2469426 0.80 CYP2C8 (0.48) CSNK1DCSNK1EBTKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2331502-B1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL MYERS SQUIBB CO (US) 2016-03-02 EP disclosed
US-8536338-B2 Compounds for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2013-09-17 US disclosed
EP-2545050-A1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C Bristol-Myers Squibb Company (US) 2013-01-16 EP disclosed
US-8293909-B2 Compounds for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2012-10-23 US disclosed
US-20120232099-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2012-09-13 US disclosed
US-8198449-B2 Compounds for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2012-06-12 US disclosed
WO-2011112186-A1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY (US) 2011-09-15 WO disclosed
EP-2331502-A2 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C Bristol-Myers Squibb Company (US) 2011-06-15 EP disclosed
US-20100184800-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2010-07-22 US disclosed
WO-2010030538-A2 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY (US) 2010-03-18 WO disclosed
US-20100063068-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2010-03-11 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 (3 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-20100063068-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 TYK2 4054/4885CSNK1D 1209/4885CSNK1E 884/4885
US-20100184800-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 TYK2 4054/4885CSNK1D 1209/4885CSNK1E 884/4885
US-20120232099-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 TYK2 4054/4885CSNK1D 1209/4885CSNK1E 884/4885

“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.