SCHEMBL1700463

SCHEMBL1700463

N#Cc1cc(S(N)(=O)=O)cnc1OCC1CCN(C2COC2F)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.38
CDK2 P24941 9/20 0.35
CDK1 P06493 7/20 0.35
CCNB1 P14635 5/20 0.35
CCNT1 O60563 4/20 0.35
CDK7 P50613 4/20 0.35
CDK9 P50750 4/20 0.35
CCNH P51946 4/20 0.35
CDK5 Q00535 4/20 0.35
CA2 P00918 2/20 0.34
CCNA2 P20248 5/20 0.33
CCNA1 P78396 5/20 0.33
IDO1 P14902 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33
CCNB2 O95067 2/20 0.32
CCNB3 Q8WWL7 2/20 0.32
NEK2 P51955 1/20 0.32
ROCK2 O75116 1/20 0.32
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32

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
SCHEMBL1868758 0.87 BRD4 (0.37) BRD4CDK2CDK1CCNB1CCNT1
SCHEMBL1700514 0.86 BRD4 (0.37) BRD4CDK2CDK1CCNB1CCNT1
SCHEMBL1866208 0.85 BRD4 (0.38) BRD4TRPV4
SCHEMBL1955447 0.78 XDH (0.44) BRD4CDK2CDK1CCNB1CCNT1
SCHEMBL1700818 0.74 MGLL (0.38) BRD4
SCHEMBL1959121 0.74 BRD4 (0.43) BRD4CDK2CDK1CCNB1CCNT1
SCHEMBL1959120 0.74 BRD4 (0.43) BRD4CDK2CDK1CCNB1CCNT1
SCHEMBL1959122 0.74 BRD4 (0.43) BRD4CDK2CDK1CCNB1CCNT1
SCHEMBL1702078 0.72 LMNA (0.42) BRD4CA2
SCHEMBL1700461 0.71 TBK1 (0.38) BRD4ENPP1

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-20150157639-A1 SOLID DISPERSIONS CONTAINING AN APOPTOSIS-INDUCING AGENT ABBVIE INC. 2015-06-11 US disclosed
EP-2576546-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES Abbvie Inc. (US) 2013-04-10 EP disclosed
EP-2507229-A1 SULFONAMIDE DERIVATIVES AS BCL-2-SELECTIVE APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE DISEASES Abbott Laboratories (US) 2012-10-10 EP disclosed
EP-2435432-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES Abbott Laboratories (US) 2012-04-04 EP disclosed
WO-2011149492-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-12-01 WO disclosed
WO-2011068561-A1 SULFONAMIDE DERIVATIVES AS BCL-2-SELECTIVE APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-06-09 WO disclosed
WO-2010138588-A9 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-05-05 WO disclosed
WO-2010138588-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2010-12-02 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-20150157639-A1 SOLID DISPERSIONS CONTAINING AN APOPTOSIS-INDUCING AGENT BCL2, BAX, BCL2L1 BRD4 2261/4885CDK2 233/4885CDK1 708/4885

“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.